BioPhytMol: A database of Phytomolecules against Mycobacteria

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Page - 1 of 2 Record - 1 of 29 [TOP]

Compound ID

3638

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

> 64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

ψ - Taraxasterol

PubChem ID

5270605

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Methanol extract, nonsaponifiable lipid fraction

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

426.386

Molecular Formula

C₃₀H₅₀O

SMILES

O[C@@H]1C(C2[C@@](C3[C@]([C@]4(C(C5[C@@](CC4)(CC=C([C@H]5C)C)C)CC3)C)(CC2)C)(CC1)C)(C)C

XLogP

11.751

PSA

20.230

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

2) Traditional Chinese Medicines

Curator

Vikramjitmandal

Record - 2 of 29 [TOP]

Compound ID

3639

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

16 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Faradiol

PubChem ID

122856

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

442.381

Molecular Formula

C₃₀H₅₀O₂

SMILES

O[C@H]1C[C@]2([C@]3(C([C@@]4([C@@H](CC3)C([C@@H](O)CC4)(C)C)C)CC[C@@H]2[C@H]2[C@@]1(CC=C([C@H]2C)C)C)C)C

XLogP

9.244

PSA

40.460

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

Curator

Vikramjitmandal

Record - 3 of 29 [TOP]

Compound ID

3640

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

> 64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Heliantriol

PubChem ID

397879

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

458.376

Molecular Formula

C₃₀H₅₀O₃

SMILES

O[C@H]1C[C@]2([C@]3([C@@H]([C@@]4([C@@H](CC3)C([C@@H](O)CC4)(C)C)C)CC[C@@H]2[C@H]2[C@@]1([C@@H](O)C=C([C@H]2C)C)C)C)C

XLogP

8.058

PSA

60.690

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

Curator

Vikramjitmandal

Record - 4 of 29 [TOP]

Compound ID

3641

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

32 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

22α - Methoxyfaradiol

PubChem ID

5273647

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

472.392

Molecular Formula

C₃₁H₅₂O₃

SMILES

O[C@@H]1[C@@]2([C@H]([C@@H]3[C@]([C@]4(C([C@@]5([C@@H](CC4)C([C@@H](O)CC5)(C)C)C)CC3)C)(C1)C)[C@@H](C(=C[C@@H]2OC)C)C)C

XLogP

8.577

PSA

49.690

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

Curator

Vikramjitmandal

Record - 5 of 29 [TOP]

Compound ID

3642

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

32 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Faradiol α - Epoxide

PubChem ID

5270606

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Epoxide

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

458.376

Molecular Formula

C₃₀H₅₀O₃

SMILES

O1[C@]2([C@H](C3C4[C@]([C@]5(C([C@@]6(C(CC5)C([C@@H](O)CC6)(C)C)C)CC4)C)(C[C@H](O)[C@]3(C[C@@H]12)C)C)C)C

XLogP

8.233

PSA

52.990

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

Curator

Vikramjitmandal

Record - 6 of 29 [TOP]

Compound ID

3643

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Taraxasterol

PubChem ID

5270604

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

426.386

Molecular Formula

C₃₀H₅₀O

SMILES

O[C@@H]1C(C2[C@@](C3[C@]([C@]4(C(C5[C@@](CC4)(CCC(=C)[C@H]5C)C)CC3)C)(CC2)C)(CC1)C)(C)C

XLogP

11.796

PSA

20.230

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

Curator

Vikramjitmandal

Record - 7 of 29 [TOP]

Compound ID

3644

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

16 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Arnidiol

PubChem ID

470259

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

442.381

Molecular Formula

C₃₀H₅₀O₂

SMILES

O[C@@H]1[C@@]2([C@H]([C@@H]3[C@]([C@]4(C([C@@]5([C@@H](CC4)C([C@@H](O)CC5)(C)C)C)CC3)C)(C1)C)[C@@H](C(=C)CC2)C)C

XLogP

9.289

PSA

40.460

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 8 of 29 [TOP]

Compound ID

3645

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

> 64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

β-Amyrin

PubChem ID

73145

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene. Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

426.386

Molecular Formula

C₃₀H₅₀O

SMILES

O[C@@H]1C([C@H]2[C@@]([C@@H]3[C@]([C@]4(C(=CC3)[C@H]3[C@@](CC4)(CCC(C3)(C)C)C)C)(CC2)C)(CC1)C)(C)C

XLogP

11.546

PSA

20.230

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 9 of 29 [TOP]

Compound ID

3646

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

4 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Maniladiol

PubChem ID

122858

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

442.381

Molecular Formula

C₃₀H₅₀O₂

SMILES

O[C@@H]1[C@@]2([C@H](C3=CCC4[C@]([C@@]3(C1)C)(CC[C@@H]1[C@@]4(CC[C@H](O)C1(C)C)C)C)CC(CC2)(C)C)C

XLogP

9.039

PSA

40.460

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 10 of 29 [TOP]

Compound ID

3647

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

> 64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Erythrodiol

PubChem ID

101761

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

442.381

Molecular Formula

C₃₀H₅₀O₂

SMILES

O[C@@H]1C([C@H]2[C@@]([C@@H]3[C@]([C@]4(C(=CC3)[C@H]3[C@@](CC4)(CCC(C3)(C)C)CO)C)(CC2)C)(CC1)C)(C)C

XLogP

9.359

PSA

40.460

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 11 of 29 [TOP]

Compound ID

3648

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

32 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Longispinogenin

PubChem ID

489920

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

472.392

Molecular Formula

C₃₁H₅₂O₃

SMILES

O[C@@H]1C([C@H]2[C@@]([C@@H]3[C@]([C@]4(C(=CC3)[C@H]3[C@@]([C@H](C4)CO)(CCC(C3)(C)C)CO)C)(CC2)C)(CC1)C)(C)C

XLogP

8.313

PSA

60.690

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 12 of 29 [TOP]

Compound ID

3649

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

> 64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Coflodiol

PubChem ID

5273648

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

442.381

Molecular Formula

C₃₀H₅₀O₂

SMILES

O[C@@H]1C([C@H]2[C@@]([C@@H]3[C@]([C@]4(C(=C5[C@@]([C@@H](O)C4)(CCC(C5)(C)C)C)CC3)C)(CC2)C)(CC1)C)(C)C

XLogP

8.294

PSA

40.460

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 13 of 29 [TOP]

Compound ID

3650

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

32 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

α - Amyrin

PubChem ID

73170

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

426.386

Molecular Formula

C₃₀H₅₀O

SMILES

O[C@@H]1C([C@H]2[C@@]([C@@H]3[C@]([C@]4(C(=CC3)[C@H]3[C@@](CC4)(CC[C@H]([C@@H]3C)C)C)C)(CC2)C)(CC1)C)(C)C

XLogP

11.448

PSA

20.230

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

Curator

Vikramjitmandal

Record - 14 of 29 [TOP]

Compound ID

3651

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

> 64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Brein

PubChem ID

5270607

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

442.381

Molecular Formula

C₃₀H₅₀O₂

SMILES

O[C@@H]1[C@@]2(C(C3=CCC4[C@]([C@@]3(C1)C)(CCC1[C@@]4(CC[C@H](O)C1(C)C)C)C)[C@H]([C@@H](CC2)C)C)C

XLogP

8.941

PSA

40.460

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 15 of 29 [TOP]

Compound ID

3652

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin

Inhibition [%]

Activity [MIC] µg/ml

32 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Uvaol

PubChem ID

92802

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene,Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

442.381

Molecular Formula

C₃₀H₅₀O₂

SMILES

O[C@@H]1C([C@H]2[C@@]([C@@H]3[C@]([C@]4(C(=CC3)[C@H]3[C@@](CC4)(CC[C@H]([C@@H]3C)C)CO)C)(CC2)C)(CC1)C)(C)C

XLogP

9.261

PSA

40.460

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 16 of 29 [TOP]

Compound ID

3653

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

> 64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Lupeol

PubChem ID

44586882

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

426.386

Molecular Formula

C₃₀H₅₀O

SMILES

O[C@@H]1C([C@H]2[C@@]([C@@H]3[C@]([C@]4(C([C@@H]5[C@@](CC4)(CC[C@H]5C(=C)C)C)CC3)C)(CC2)C)(CC1)C)(C)C

XLogP

11.901

PSA

20.230

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 17 of 29 [TOP]

Compound ID

3654

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

4 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

3 - Epilupeol

PubChem ID

3083852

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene,Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

426.386

Molecular Formula

C₃₀H₅₀O

SMILES

O[C@H]1C([C@H]2[C@@](C3[C@]([C@]4([C@@H](C5[C@@](CC4)(CC[C@H]5C(=C)C)C)CC3)C)(CC2)C)(CC1)C)(C)C

XLogP

11.901

PSA

20.230

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 18 of 29 [TOP]

Compound ID

3655

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Calenduladiol

PubChem ID

461835

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

442.381

Molecular Formula

C₃₀H₅₀O₂

SMILES

O[C@@H]1[C@@]2([C@@H]([C@@H]3[C@]([C@]4([C@@H]([C@@]5([C@@H](CC4)C([C@@H](O)CC5)(C)C)C)CC3)C)(C1)C)[C@@H](CC2)C(=C)C)C

XLogP

9.394

PSA

40.460

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 19 of 29 [TOP]

Compound ID

3656

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

> 64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Heliantriol B₂

PubChem ID

5270612

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

458.376

Molecular Formula

C₃₀H₅₀O₃

SMILES

O[C@@H]1[C@@]2(C(C3[C@]([C@]4(C([C@@]5(C(CC4)C([C@@H](O)CC5)(C)C)C)CC3)C)(C1)C)[C@@H](CC2)C(=C)C)CO

XLogP

8.691

PSA

60.690

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 20 of 29 [TOP]

Compound ID

3657

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

> 64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Taraxerol

PubChem ID

92097

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

426.386

Molecular Formula

C₃₀H₅₀O

SMILES

O[C@@H]1C([C@H]2[C@@]([C@@H]3[C@](C4=CC[C@@]5([C@H]([C@@]4(CC3)C)CC(CC5)(C)C)C)(CC2)C)(CC1)C)(C)C

XLogP

11.352

PSA

20.230

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 21 of 29 [TOP]

Compound ID

3658

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

> 64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Cycloartenol

PubChem ID

17750995

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Cycloartane, Prenylated, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

426.386

Molecular Formula

C₃₀H₅₀O

SMILES

O[C@@H]1C([C@H]2[C@@]3([C@]4(C3)[C@H]([C@]3([C@](CC4)([C@H](CC3)[C@@H](CCC=C(C)C)C)C)C)CC2)CC1)(C)C

XLogP

11.921

PSA

20.230

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 22 of 29 [TOP]

Compound ID

3659

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

24 - Methylenecycloartanol

PubChem ID

94204

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Cycloartane, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

440.402

Molecular Formula

C₃₁H₅₂O

SMILES

O[C@@H]1C([C@H]2[C@@]3([C@@]4(C3)[C@H]([C@]3([C@](CC4)([C@H](CC3)[C@@H](CCC(=C)C(C)C)C)C)C)CC2)CC1)(C)C

XLogP

12.365

PSA

20.230

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 23 of 29 [TOP]

Compound ID

3660

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

> 64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

(24R) - Cycloartane - 3β, 24, 25 - Triol

PubChem ID

5270670

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Cycloartane, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

460.392

Molecular Formula

C₃₀H₅₂O₃

SMILES

O[C@@H]1C([C@H]2[C@@]3([C@@]4(C3)[C@H]([C@]3([C@](CC4)([C@H](CC3)[C@@H](CC[C@@H](O)C(O)(C)C)C)C)C)CC2)CC1)(C)C

XLogP

9.572

PSA

60.690

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 24 of 29 [TOP]

Compound ID

3661

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

32 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

(24S) - Cycloartane - 3β, 24, 25 - Triol

PubChem ID

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene, Cycloartane, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

460.392

Molecular Formula

C₃₀H₅₂O₃

SMILES

C1C[C@@H](C([C@H]2C31C1([C@@H](CC2)[C@]2([C@](CC1)([C@H](CC2)[C@H](C)CCC(C(C)(C)O)O)C)C)C3)(C)C)O

XLogP

9.572

PSA

60.690

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

Record - 25 of 29 [TOP]

Compound ID

3662

Compound Structure

Plant Source

Chrysanthemum morifolium RAMAT. Common Name:Chrysanthemum

Source Family

Asteraceae (Compositae)

Origin

Asia and Northeastern Europe

Plant Part Used

Flower

Extract

Methanol

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27 294)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Rifampin (0.25 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

> 64 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

(24S) - 25 - Methoxycycloartane - 3β, 24-diol

PubChem ID

5270669

Ethnomedicinal Information

Anti - inflammatory, analgesic, antipyretic

PubMed ID [Source Literature]

15635183

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Pentacyclic, Terpene, Triterpene,Cycloartane, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H12 medium

Cytotoxicity Assay [AID]

Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay

Molecular Weight

474.407

Molecular Formula

C₃₁H₅₄O₃

SMILES

O[C@@H]1C([C@H]2[C@@]3([C@@]4(C3)[C@H]([C@]3([C@](CC4)([C@H](CC3)[C@@H](CC[C@H](O)C(OC)(C)C)C)C)C)CC2)CC1)(C)C

XLogP

10.091

PSA

49.690

H-bond Donor

H-bond Acceptor

No. of Rotatable Bond Count

No. of Rings

No. of N

No. of O

No. of S

Reference(s)

1) Akihisa T, Franzblau SG, Ukiya M, Okuda H, Zhang F, Yasukawa K, Suzuki T, Kimura Y.Antitubercular activity of triterpenoids from Asteraceae flowers.Biol Pharm Bull. 2005 Jan;28(1):158-60

Curator

Vikramjitmandal

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