BioPhytMol: A database of Phytomolecules against Mycobacteria

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Page - 1 of 1 Record - 1 of 12 [TOP]

Compound ID

2100

Compound Structure

Plant Source

Magnolia grandiflora L. Common Name:Bull Bay, Great Laurel Magnolia, Southern Magnolia (English), Him - Champaa (Sanskrit)

Source Family

Magnoliaceae

Origin

India, USA

Plant Part Used

Extract

Target Bacteria

Mycobacterium tuberculosis

Assay / Test Done

Radiorespirometric Bioassay

Positive Control Used (conc.)

Rifampin (0.25 - 0.125 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

32 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Costunolide

PubChem ID

5281437

Ethnomedicinal Information

Stimulant, diaphoretic, tonic, malaria, rheumatism, random screening

PubMed ID [Source Literature]

9747541

Extract Preparation

N/A

Chemical Classification [Active Compound]

Alicyclic, Bicyclic, Terpene, Sesquiterpene, Lactone

Media / Broth Used [Antimicrobial Assay/Test]

N/A

Cytotoxicity Assay [AID]

N/A

Molecular Weight

232.146

Molecular Formula

C₁₅H₂₀O₂

SMILES

O1[C@H]2[C@@H](CC/C(=C/CC/C(=C/2)/C)/C)C(=C)C1=O

XLogP

3.308

PSA

26.300

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) Fischer NH, Lu T, Cantrell CL, Castañeda-Acosta J, Quijano L, Franzblau SG.Antimycobacterial evaluation of germacranolides.Phytochemistry. 1998 Sep;49(2):559-64

Curator

Record - 2 of 12 [TOP]

Compound ID

2103

Compound Structure

Plant Source

Magnolia grandiflora L. Common Name:Bull Bay, Great Laurel Magnolia, Southern Magnolia (English), Him - Champaa (Sanskrit)

Source Family

Magnoliaceae

Origin

India, USA

Plant Part Used

Extract

Target Bacteria

Mycobacterium avium

Assay / Test Done

Radiorespirometric Bioassay

Positive Control Used (conc.)

Clarithroycin (1 - 2 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

128 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Costunolide

PubChem ID

5281437

Ethnomedicinal Information

Stimulant, diaphoretic, tonic, malaria, rheumatism, random screening

PubMed ID [Source Literature]

9747541

Extract Preparation

N/A

Chemical Classification [Active Compound]

Alicyclic, Bicyclic, Terpene, Sesquiterpene, Lactone

Media / Broth Used [Antimicrobial Assay/Test]

N/A

Cytotoxicity Assay [AID]

N/A

Molecular Weight

232.146

Molecular Formula

C₁₅H₂₀O₂

SMILES

O1[C@H]2[C@@H](CC/C(=C/CC/C(=C/2)/C)/C)C(=C)C1=O

XLogP

3.308

PSA

26.300

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) Fischer NH, Lu T, Cantrell CL, Castañeda-Acosta J, Quijano L, Franzblau SG.Antimycobacterial evaluation of germacranolides.Phytochemistry. 1998 Sep;49(2):559-64

Curator

Record - 3 of 12 [TOP]

Compound ID

2113

Compound Structure

Plant Source

Magnolia virginiana Common Name:

Source Family

Magnoliaceae

Origin

USA

Plant Part Used

Extract

Target Bacteria

Mycobacterium tuberculosis

Assay / Test Done

Radiorespirometric Bioassay

Positive Control Used (conc.)

Rifampin (0.25 - 0.125 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

32 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Costunolide

PubChem ID

5281437

Ethnomedicinal Information

In the treatment of malaria and is also taken internally in the treatment of colds, bronchial diseases, upper respiratory tract infections, rheumatism and gout

PubMed ID [Source Literature]

9747541

Extract Preparation

N/A

Chemical Classification [Active Compound]

Alicyclic, Bicyclic, Terpene, Sesquiterpene, Lactone

Media / Broth Used [Antimicrobial Assay/Test]

N/A

Cytotoxicity Assay [AID]

N/A

Molecular Weight

232.146

Molecular Formula

C₁₅H₂₀O₂

SMILES

O1[C@H]2[C@@H](CC/C(=C/CC/C(=C/2)/C)/C)C(=C)C1=O

XLogP

3.308

PSA

26.300

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) Fischer NH, Lu T, Cantrell CL, Castañeda-Acosta J, Quijano L, Franzblau SG.Antimycobacterial evaluation of germacranolides.Phytochemistry. 1998 Sep;49(2):559-64

Curator

Record - 4 of 12 [TOP]

Compound ID

3762

Compound Structure

Plant Source

Laurus novocanariensis Common Name:

Source Family

Lauraceae

Origin

Plant Part Used

Ripe fruit

Extract

Laurel oil

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 27294)

Assay / Test Done

Fluorometric Alamar Blue Microassay (FMABA)

Positive Control Used (conc.)

Inhibition [%]

Activity [MIC] µg/ml

12.5 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Costunolide

PubChem ID

5281437

Ethnomedicinal Information

Anti-inflammatory, skin infections, anti-rheumatic, vulnerary, blood depurative, stomachic, haemostatic, influenza, apoplexy, constipation

PubMed ID [Source Literature]

17218447

Extract Preparation

Volatile components were removed by hydrodistillation of the oil in a Clevenger - type apparatus to yield the essential oil and an odourless residue containing the lipids and other non - volatile compounds. The residue was partitioned between n - hexane and methanol to separate the lipid fraction from the more polar compounds, including the lactones. The methanolic fraction containing mainly the lactones costunolide (1) and dehydrocostuslactone (2) was further fractioned by column chromatography. 1 and 2 were identified by their mass spectra, and proton and carbon NMR spectra and their purity established as > 95 % by gas chromatography

Chemical Classification [Active Compound]

Alicyclic, Bicyclic, Terpene, Sesquiterpene, Lactone

Media / Broth Used [Antimicrobial Assay/Test]

Cytotoxicity Assay [AID]

Molecular Weight

232.146

Molecular Formula

C₁₅H₂₀O₂

SMILES

O1[C@H]2[C@@H](CC/C(=C/CC/C(=C/2)/C)/C)C(=C)C1=O

XLogP

3.308

PSA

26.300

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) Luna-Herrera J, Costa MC, González HG, Rodrigues AI, Castilho PC.Synergistic antimycobacterial activities of sesquiterpene lactones from Laurus spp.J Antimicrob Chemother. 2007 Mar;59(3):548-52

Curator

Vikramjitmandal

Record - 5 of 12 [TOP]

Compound ID

3763

Compound Structure

Plant Source

Laurus novocanariensis Common Name:

Source Family

Lauraceae

Origin

Plant Part Used

Ripe fruit

Extract

Laurel oil

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 35822) (Isoniazid resistant)

Assay / Test Done

Fluorometric Alamar Blue Microassay (FMABA)

Positive Control Used (conc.)

Inhibition [%]

Activity [MIC] µg/ml

12.5 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Costunolide

PubChem ID

5281437

Ethnomedicinal Information

Anti-inflammatory, skin infections, anti-rheumatic, vulnerary, blood depurative, stomachic, haemostatic, influenza, apoplexy, constipation

PubMed ID [Source Literature]

17218447

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Bicyclic, Terpene, Sesquiterpene, Lactone

Media / Broth Used [Antimicrobial Assay/Test]

Cytotoxicity Assay [AID]

Molecular Weight

232.146

Molecular Formula

C₁₅H₂₀O₂

SMILES

O1[C@H]2[C@@H](CC/C(=C/CC/C(=C/2)/C)/C)C(=C)C1=O

XLogP

3.308

PSA

26.300

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) Luna-Herrera J, Costa MC, González HG, Rodrigues AI, Castilho PC.Synergistic antimycobacterial activities of sesquiterpene lactones from Laurus spp.J Antimicrob Chemother. 2007 Mar;59(3):548-52

Curator

Vikramjitmandal

Record - 6 of 12 [TOP]

Compound ID

3764

Compound Structure

Plant Source

Laurus novocanariensis Common Name:

Source Family

Lauraceae

Origin

Plant Part Used

Ripe fruit

Extract

Laurel oil

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 35838) (Rifampin resistant)

Assay / Test Done

Fluorometric Alamar Blue Microassay (FMABA)

Positive Control Used (conc.)

Inhibition [%]

Activity [MIC] µg/ml

6.25 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Costunolide

PubChem ID

5281437

Ethnomedicinal Information

Anti-inflammatory, skin infections, anti-rheumatic, vulnerary, blood depurative, stomachic, haemostatic, influenza, apoplexy, constipation

PubMed ID [Source Literature]

17218447

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Bicyclic, Terpene, Sesquiterpene, Lactone

Media / Broth Used [Antimicrobial Assay/Test]

Cytotoxicity Assay [AID]

Molecular Weight

232.146

Molecular Formula

C₁₅H₂₀O₂

SMILES

O1[C@H]2[C@@H](CC/C(=C/CC/C(=C/2)/C)/C)C(=C)C1=O

XLogP

3.308

PSA

26.300

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) Luna-Herrera J, Costa MC, González HG, Rodrigues AI, Castilho PC.Synergistic antimycobacterial activities of sesquiterpene lactones from Laurus spp.J Antimicrob Chemother. 2007 Mar;59(3):548-52

Curator

Vikramjitmandal

Record - 7 of 12 [TOP]

Compound ID

3765

Compound Structure

Plant Source

Laurus novocanariensis Common Name:

Source Family

Lauraceae

Origin

Plant Part Used

Ripe fruit

Extract

Laurel oil

Target Bacteria

Mycobacterium tuberculosis H37Rv (Streptomycin resistant)

Assay / Test Done

Fluorometric Alamar Blue Microassay (FMABA)

Positive Control Used (conc.)

Inhibition [%]

Activity [MIC] µg/ml

25 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Costunolide

PubChem ID

5281437

Ethnomedicinal Information

Anti-inflammatory, skin infections, anti-rheumatic, vulnerary, blood depurative, stomachic, haemostatic, influenza, apoplexy, constipation

PubMed ID [Source Literature]

17218447

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Bicyclic, Terpene, Sesquiterpene, Lactone

Media / Broth Used [Antimicrobial Assay/Test]

Cytotoxicity Assay [AID]

Molecular Weight

232.146

Molecular Formula

C₁₅H₂₀O₂

SMILES

O1[C@H]2[C@@H](CC/C(=C/CC/C(=C/2)/C)/C)C(=C)C1=O

XLogP

3.308

PSA

26.300

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) Luna-Herrera J, Costa MC, González HG, Rodrigues AI, Castilho PC.Synergistic antimycobacterial activities of sesquiterpene lactones from Laurus spp.J Antimicrob Chemother. 2007 Mar;59(3):548-52

Curator

Vikramjitmandal

Record - 8 of 12 [TOP]

Compound ID

3766

Compound Structure

Plant Source

Laurus novocanariensis Common Name:

Source Family

Lauraceae

Origin

Plant Part Used

Ripe fruit

Extract

Laurel oil

Target Bacteria

Mycobacterium tuberculosis H37Rv (ATCC 35837) (Ethambutol resistant)

Assay / Test Done

Fluorometric Alamar Blue Microassay (FMABA)

Positive Control Used (conc.)

Inhibition [%]

Activity [MIC] µg/ml

12.5 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Costunolide

PubChem ID

5281437

Ethnomedicinal Information

Anti-inflammatory, skin infections, anti-rheumatic, vulnerary, blood depurative, stomachic, haemostatic, influenza, apoplexy, constipation

PubMed ID [Source Literature]

17218447

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Bicyclic, Terpene, Sesquiterpene, Lactone

Media / Broth Used [Antimicrobial Assay/Test]

Cytotoxicity Assay [AID]

Molecular Weight

232.146

Molecular Formula

C₁₅H₂₀O₂

SMILES

O1[C@H]2[C@@H](CC/C(=C/CC/C(=C/2)/C)/C)C(=C)C1=O

XLogP

3.308

PSA

26.300

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) Luna-Herrera J, Costa MC, González HG, Rodrigues AI, Castilho PC.Synergistic antimycobacterial activities of sesquiterpene lactones from Laurus spp.J Antimicrob Chemother. 2007 Mar;59(3):548-52

Curator

Vikramjitmandal

Record - 9 of 12 [TOP]

Compound ID

3767

Compound Structure

Plant Source

Laurus novocanariensis Common Name:

Source Family

Lauraceae

Origin

Plant Part Used

Ripe fruit

Extract

Laurel oil

Target Bacteria

Mycobacterium tuberculosis (Clinical isolate MMDO) (Isoniazid and Ethambutol resistant)

Assay / Test Done

Fluorometric Alamar Blue Microassay (FMABA)

Positive Control Used (conc.)

Inhibition [%]

Activity [MIC] µg/ml

25 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Costunolide

PubChem ID

5281437

Ethnomedicinal Information

Anti-inflammatory, skin infections, anti-rheumatic, vulnerary, blood depurative, stomachic, haemostatic, influenza, apoplexy, constipation

PubMed ID [Source Literature]

17218447

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Bicyclic, Terpene, Sesquiterpene, Lactone

Media / Broth Used [Antimicrobial Assay/Test]

Cytotoxicity Assay [AID]

Molecular Weight

232.146

Molecular Formula

C₁₅H₂₀O₂

SMILES

O1[C@H]2[C@@H](CC/C(=C/CC/C(=C/2)/C)/C)C(=C)C1=O

XLogP

3.308

PSA

26.300

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) Luna-Herrera J, Costa MC, González HG, Rodrigues AI, Castilho PC.Synergistic antimycobacterial activities of sesquiterpene lactones from Laurus spp.J Antimicrob Chemother. 2007 Mar;59(3):548-52

Curator

Vikramjitmandal

Record - 10 of 12 [TOP]

Compound ID

3768

Compound Structure

Plant Source

Laurus novocanariensis Common Name:

Source Family

Lauraceae

Origin

Plant Part Used

Ripe fruit

Extract

Laurel oil

Target Bacteria

Mycobacterium tuberculosis (Clinical isolate SIN4) (Isoniazid, Rifampicin, Streptomycin and Ethambutol resistant)

Assay / Test Done

Fluorometric Alamar Blue Microassay (FMABA)

Positive Control Used (conc.)

Inhibition [%]

Activity [MIC] µg/ml

25 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Costunolide

PubChem ID

5281437

Ethnomedicinal Information

Anti-inflammatory, skin infections, anti-rheumatic, vulnerary, blood depurative, stomachic, haemostatic, influenza, apoplexy, constipation

PubMed ID [Source Literature]

17218447

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Bicyclic, Terpene, Sesquiterpene, Lactone

Media / Broth Used [Antimicrobial Assay/Test]

Cytotoxicity Assay [AID]

Molecular Weight

232.146

Molecular Formula

C₁₅H₂₀O₂

SMILES

O1[C@H]2[C@@H](CC/C(=C/CC/C(=C/2)/C)/C)C(=C)C1=O

XLogP

3.308

PSA

26.300

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) Luna-Herrera J, Costa MC, González HG, Rodrigues AI, Castilho PC.Synergistic antimycobacterial activities of sesquiterpene lactones from Laurus spp.J Antimicrob Chemother. 2007 Mar;59(3):548-52

Curator

Vikramjitmandal

Record - 11 of 12 [TOP]

Compound ID

3769

Compound Structure

Plant Source

Laurus novocanariensis Common Name:

Source Family

Lauraceae

Origin

Plant Part Used

Ripe fruit

Extract

Laurel oil

Target Bacteria

Mycobacterium tuberculosis (Clinical isolate MTY 147) (Isoniazid and Rifampicin resistant)

Assay / Test Done

Fluorometric Alamar Blue Microassay (FMABA)

Positive Control Used (conc.)

Inhibition [%]

Activity [MIC] µg/ml

50 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Costunolide

PubChem ID

5281437

Ethnomedicinal Information

Anti-inflammatory, skin infections, anti-rheumatic, vulnerary, blood depurative, stomachic, haemostatic, influenza, apoplexy, constipation

PubMed ID [Source Literature]

17218447

Extract Preparation

Chemical Classification [Active Compound]

Alicyclic, Bicyclic, Terpene, Sesquiterpene, Lactone

Media / Broth Used [Antimicrobial Assay/Test]

Cytotoxicity Assay [AID]

Molecular Weight

232.146

Molecular Formula

C₁₅H₂₀O₂

SMILES

O1[C@H]2[C@@H](CC/C(=C/CC/C(=C/2)/C)/C)C(=C)C1=O

XLogP

3.308

PSA

26.300

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) Luna-Herrera J, Costa MC, González HG, Rodrigues AI, Castilho PC.Synergistic antimycobacterial activities of sesquiterpene lactones from Laurus spp.J Antimicrob Chemother. 2007 Mar;59(3):548-52

Curator

Vikramjitmandal

Record - 12 of 12 [TOP]

Compound ID

2116

Compound Structure

Plant Source

Magnolia virginiana Common Name:

Source Family

Magnoliaceae

Origin

USA

Plant Part Used

Extract

Target Bacteria

Mycobacterium avium

Assay / Test Done

Radiorespirometric Bioassay

Positive Control Used (conc.)

Clarithroycin (1 - 2 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

128 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Costunolide

PubChem ID

5281437

Ethnomedicinal Information

In the treatment of malaria and is also taken internally in the treatment of colds, bronchial diseases, upper respiratory tract infections, rheumatism and gout

PubMed ID [Source Literature]

9747541

Extract Preparation

N/A

Chemical Classification [Active Compound]

Alicyclic, Bicyclic, Terpene, Sesquiterpene, Lactone

Media / Broth Used [Antimicrobial Assay/Test]

N/A

Cytotoxicity Assay [AID]

N/A

Molecular Weight

232.146

Molecular Formula

C₁₅H₂₀O₂

SMILES

O1[C@H]2[C@@H](CC/C(=C/CC/C(=C/2)/C)/C)C(=C)C1=O

XLogP

3.308

PSA

26.300

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) Fischer NH, Lu T, Cantrell CL, Castañeda-Acosta J, Quijano L, Franzblau SG.Antimycobacterial evaluation of germacranolides.Phytochemistry. 1998 Sep;49(2):559-64

Curator

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