BioPhytMol: A database of Phytomolecules against Mycobacteria

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Page - 1 of 1 Record - 1 of 13 [TOP]

Compound ID

3002

Compound Structure

Plant Source

Curcuma longa Common Name:Turmeric

Source Family

Zingiberaceae

Origin

Southeast Asia

Plant Part Used

Root

Extract

Target Bacteria

Mycobacterium tuberculosis M3 (MDR (Multi - drug - resistant) strains which are Isoniazid, Rifampin and Streptomycin resistant)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Kanamycin (2.5 µg/ml), Isoniazid (0.06 µg/ml), Rifampin (0.004 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

1.56 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole (Pentylation on the other ring)

PubChem ID

Ethnomedicinal Information

PubMed ID [Source Literature]

20691508

Extract Preparation

Treatment with hydroxylamine hydrochloride in pyridin, HPLC, NMR analysis, shade - dried, ground and extracted

Chemical Classification [Active Compound]

Aromatic, Alkene, Curcuminoid, Isoxazole, Ether

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H9GC

Cytotoxicity Assay [AID]

Molecular Weight

435.205

Molecular Formula

C₂₆H₂₉NO₅

SMILES

C1c(c(ccc1/C=C/c1cc(/C=C/c2cc(c(cc2)OCCCCC)OC)on1)O)OC

XLogP

6.765

PSA

73.950

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) Changtam C, Hongmanee P, Suksamrarn A.Isoxazole analogs of curcuminoids with highly potent multidrug-resistant antimycobacterial activity.Eur J Med Chem. 2010 Oct;45(10):4446-57

Curator

KeyaMukherjee, vsheeba

Record - 2 of 13 [TOP]

Compound ID

3003

Compound Structure

Plant Source

Curcuma longa Common Name:Turmeric

Source Family

Zingiberaceae

Origin

Southeast Asia

Plant Part Used

Root

Extract

Target Bacteria

Mycobacterium tuberculosis M4 (MDR (Multi - drug - resistant) strains which are Isoniazid, Rifampin, Ethambutol and Streptomycin resistant)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Kanamycin (2.5 µg/ml), Isoniazid (0.06 µg/ml), Rifampin (0.004 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

1.56 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole (Pentylation on the other ring)

PubChem ID

Ethnomedicinal Information

PubMed ID [Source Literature]

20691508

Extract Preparation

Treatment with hydroxylamine hydrochloride in pyridin, HPLC, NMR analysis, shade - dried, ground and extracted

Chemical Classification [Active Compound]

Aromatic, Alkene, Curcuminoid, Isoxazole, Ether

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H9GC

Cytotoxicity Assay [AID]

Molecular Weight

435.205

Molecular Formula

C₂₆H₂₉NO₅

SMILES

C1c(c(ccc1/C=C/c1cc(/C=C/c2cc(c(cc2)OCCCCC)OC)on1)O)OC

XLogP

6.765

PSA

73.950

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) Changtam C, Hongmanee P, Suksamrarn A.Isoxazole analogs of curcuminoids with highly potent multidrug-resistant antimycobacterial activity.Eur J Med Chem. 2010 Oct;45(10):4446-57

Curator

KeyaMukherjee, vsheeba

Record - 3 of 13 [TOP]

Compound ID

3004

Compound Structure

Plant Source

Curcuma longa Common Name:Turmeric

Source Family

Zingiberaceae

Origin

Southeast Asia

Plant Part Used

Root

Extract

Target Bacteria

Mycobacterium tuberculosis M5 (MDR (Multi - drug - resistant) strains which are Isoniazid, Rifampin and Streptomycin resistant)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Kanamycin (2.5 µg/ml), Isoniazid (0.06 µg/ml), Rifampin (0.004 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

1.56 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole (Pentylation on the other ring)

PubChem ID

Ethnomedicinal Information

PubMed ID [Source Literature]

20691508

Extract Preparation

Treatment with hydroxylamine hydrochloride in pyridin, HPLC, NMR analysis, shade - dried, ground and extracted

Chemical Classification [Active Compound]

Aromatic, Alkene, Curcuminoid, Isoxazole, Ether

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H9GC

Cytotoxicity Assay [AID]

Molecular Weight

435.205

Molecular Formula

C₂₆H₂₉NO₅

SMILES

C1c(c(ccc1/C=C/c1cc(/C=C/c2cc(c(cc2)OCCCCC)OC)on1)O)OC

XLogP

6.765

PSA

73.950

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) Changtam C, Hongmanee P, Suksamrarn A.Isoxazole analogs of curcuminoids with highly potent multidrug-resistant antimycobacterial activity.Eur J Med Chem. 2010 Oct;45(10):4446-57

Curator

KeyaMukherjee, vsheeba

Record - 4 of 13 [TOP]

Compound ID

3005

Compound Structure

Plant Source

Curcuma longa Common Name:Turmeric

Source Family

Zingiberaceae

Origin

Southeast Asia

Plant Part Used

Root

Extract

Target Bacteria

Mycobacterium tuberculosis M6 (MDR (Multi - drug - resistant) strains which are Isoniazid and Rifampin resistant)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Kanamycin (2.5 µg/ml), Isoniazid (0.06 µg/ml), Rifampin (0.004 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

3.125 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole (Pentylation on the other ring)

PubChem ID

Ethnomedicinal Information

PubMed ID [Source Literature]

20691508

Extract Preparation

Treatment with hydroxylamine hydrochloride in pyridin, HPLC, NMR analysis, shade - dried, ground and extracted

Chemical Classification [Active Compound]

Aromatic, Alkene, Curcuminoid, Isoxazole, Ether

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H9GC

Cytotoxicity Assay [AID]

Molecular Weight

435.205

Molecular Formula

C₂₆H₂₉NO₅

SMILES

C1c(c(ccc1/C=C/c1cc(/C=C/c2cc(c(cc2)OCCCCC)OC)on1)O)OC

XLogP

6.765

PSA

73.950

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) Changtam C, Hongmanee P, Suksamrarn A.Isoxazole analogs of curcuminoids with highly potent multidrug-resistant antimycobacterial activity.Eur J Med Chem. 2010 Oct;45(10):4446-57

Curator

KeyaMukherjee, vsheeba

Record - 5 of 13 [TOP]

Compound ID

3006

Compound Structure

Plant Source

Curcuma longa Common Name:Turmeric

Source Family

Zingiberaceae

Origin

Southeast Asia

Plant Part Used

Root

Extract

Target Bacteria

Mycobacterium tuberculosis M8 (Isoniazid, Rifampin, Ethambutol, Streptomycin resistant)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Kanamycin (2.5 µg/ml), Isoniazid (0.06 µg/ml), Rifampin (0.004 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

6.25 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole (Pentylation on the other ring)

PubChem ID

Ethnomedicinal Information

PubMed ID [Source Literature]

20691508

Extract Preparation

Treatment with hydroxylamine hydrochloride in pyridin, HPLC, NMR analysis, shade - dried, ground and extracted

Chemical Classification [Active Compound]

Aromatic, Alkene, Curcuminoid, Isoxazole, Ether

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H9GC

Cytotoxicity Assay [AID]

Molecular Weight

435.205

Molecular Formula

C₂₆H₂₉NO₅

SMILES

C1c(c(ccc1/C=C/c1cc(/C=C/c2cc(c(cc2)OCCCCC)OC)on1)O)OC

XLogP

6.765

PSA

73.950

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) Changtam C, Hongmanee P, Suksamrarn A.Isoxazole analogs of curcuminoids with highly potent multidrug-resistant antimycobacterial activity.Eur J Med Chem. 2010 Oct;45(10):4446-57

Curator

KeyaMukherjee, vsheeba

Record - 6 of 13 [TOP]

Compound ID

3007

Compound Structure

Plant Source

Curcuma longa Common Name:Turmeric

Source Family

Zingiberaceae

Origin

Southeast Asia

Plant Part Used

Root

Extract

Target Bacteria

Mycobacterium tuberculosis M11 (MDR (Multi - drug - resistant) strains which are Isoniazid and Rifampin resistant)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Kanamycin (2.5 µg/ml), Isoniazid (0.06 µg/ml), Rifampin (0.004 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

6.25 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole (Pentylation on the other ring)

PubChem ID

Ethnomedicinal Information

PubMed ID [Source Literature]

20691508

Extract Preparation

Treatment with hydroxylamine hydrochloride in pyridin, HPLC, NMR analysis, shade - dried, ground and extracted

Chemical Classification [Active Compound]

Aromatic, Alkene, Curcuminoid, Isoxazole, Ether

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H9GC

Cytotoxicity Assay [AID]

Molecular Weight

435.205

Molecular Formula

C₂₆H₂₉NO₅

SMILES

C1c(c(ccc1/C=C/c1cc(/C=C/c2cc(c(cc2)OCCCCC)OC)on1)O)OC

XLogP

6.765

PSA

73.950

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) Changtam C, Hongmanee P, Suksamrarn A.Isoxazole analogs of curcuminoids with highly potent multidrug-resistant antimycobacterial activity.Eur J Med Chem. 2010 Oct;45(10):4446-57

Curator

KeyaMukherjee, vsheeba

Record - 7 of 13 [TOP]

Compound ID

3008

Compound Structure

Plant Source

Curcuma longa Common Name:Turmeric

Source Family

Zingiberaceae

Origin

Southeast Asia

Plant Part Used

Root

Extract

Target Bacteria

Mycobacterium tuberculosis M16 (MDR (Multi - drug - resistant) strains which are Isoniazid, Rifampin and Ethambutol resistant)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Kanamycin (2.5 µg/ml), Isoniazid (0.06 µg/ml), Rifampin (0.004 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

1.56 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole (Pentylation on the other ring)

PubChem ID

Ethnomedicinal Information

PubMed ID [Source Literature]

20691508

Extract Preparation

Treatment with hydroxylamine hydrochloride in pyridin, HPLC, NMR analysis, shade - dried, ground and extracted

Chemical Classification [Active Compound]

Aromatic, Alkene, Curcuminoid, Isoxazole, Ether

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H9GC

Cytotoxicity Assay [AID]

Molecular Weight

435.205

Molecular Formula

C₂₆H₂₉NO₅

SMILES

C1c(c(ccc1/C=C/c1cc(/C=C/c2cc(c(cc2)OCCCCC)OC)on1)O)OC

XLogP

6.765

PSA

73.950

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) Changtam C, Hongmanee P, Suksamrarn A.Isoxazole analogs of curcuminoids with highly potent multidrug-resistant antimycobacterial activity.Eur J Med Chem. 2010 Oct;45(10):4446-57

Curator

KeyaMukherjee, vsheeba

Record - 8 of 13 [TOP]

Compound ID

3009

Compound Structure

Plant Source

Curcuma longa Common Name:Turmeric

Source Family

Zingiberaceae

Origin

Southeast Asia

Plant Part Used

Root

Extract

Target Bacteria

Mycobacterium tuberculosis M21 (MDR (Multi - drug - resistant) strains which are Isoniazid, Rifampin, Ethambutol and Streptomycin resistant)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Kanamycin (2.5 µg/ml), Isoniazid (0.06 µg/ml), Rifampin (0.004 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

6.25 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole (Pentylation on the other ring)

PubChem ID

Ethnomedicinal Information

PubMed ID [Source Literature]

20691508

Extract Preparation

Treatment with hydroxylamine hydrochloride in pyridin, HPLC, NMR analysis, shade - dried, ground and extracted

Chemical Classification [Active Compound]

Aromatic, Alkene, Curcuminoid, Isoxazole, Ether

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H9GC

Cytotoxicity Assay [AID]

Molecular Weight

435.205

Molecular Formula

C₂₆H₂₉NO₅

SMILES

C1c(c(ccc1/C=C/c1cc(/C=C/c2cc(c(cc2)OCCCCC)OC)on1)O)OC

XLogP

6.765

PSA

73.950

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) Changtam C, Hongmanee P, Suksamrarn A.Isoxazole analogs of curcuminoids with highly potent multidrug-resistant antimycobacterial activity.Eur J Med Chem. 2010 Oct;45(10):4446-57

Curator

KeyaMukherjee, vsheeba

Record - 9 of 13 [TOP]

Compound ID

3010

Compound Structure

Plant Source

Curcuma longa Common Name:Turmeric

Source Family

Zingiberaceae

Origin

Southeast Asia

Plant Part Used

Root

Extract

Target Bacteria

Mycobacterium tuberculosis M22 (MDR (Multi - drug - resistant) strains which are Isoniazid and Rifampin resistant)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Kanamycin (2.5 µg/ml), Isoniazid (0.06 µg/ml), Rifampin (0.004 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

6.25 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole (Pentylation on the other ring)

PubChem ID

Ethnomedicinal Information

PubMed ID [Source Literature]

20691508

Extract Preparation

Treatment with hydroxylamine hydrochloride in pyridin, HPLC, NMR analysis, shade - dried, ground and extracted

Chemical Classification [Active Compound]

Aromatic, Alkene, Curcuminoid, Isoxazole, Ether

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H9GC

Cytotoxicity Assay [AID]

Molecular Weight

435.205

Molecular Formula

C₂₆H₂₉NO₅

SMILES

C1c(c(ccc1/C=C/c1cc(/C=C/c2cc(c(cc2)OCCCCC)OC)on1)O)OC

XLogP

6.765

PSA

73.950

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) Changtam C, Hongmanee P, Suksamrarn A.Isoxazole analogs of curcuminoids with highly potent multidrug-resistant antimycobacterial activity.Eur J Med Chem. 2010 Oct;45(10):4446-57

Curator

KeyaMukherjee, vsheeba

Record - 10 of 13 [TOP]

Compound ID

3011

Compound Structure

Plant Source

Curcuma longa Common Name:Turmeric

Source Family

Zingiberaceae

Origin

Southeast Asia

Plant Part Used

Root

Extract

Target Bacteria

Mycobacterium tuberculosis M27 (MDR (Multi - drug - resistant) strains which are Isoniazid and Rifampin resistant)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Kanamycin (2.5 µg/ml), Isoniazid (0.06 µg/ml), Rifampin (0.004 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

1.56 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole (Pentylation on the other ring)

PubChem ID

Ethnomedicinal Information

PubMed ID [Source Literature]

20691508

Extract Preparation

Treatment with hydroxylamine hydrochloride in pyridin, HPLC, NMR analysis, shade - dried, ground and extracted

Chemical Classification [Active Compound]

Aromatic, Alkene, Curcuminoid, Isoxazole, Ether

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H9GC

Cytotoxicity Assay [AID]

Molecular Weight

435.205

Molecular Formula

C₂₆H₂₉NO₅

SMILES

C1c(c(ccc1/C=C/c1cc(/C=C/c2cc(c(cc2)OCCCCC)OC)on1)O)OC

XLogP

6.765

PSA

73.950

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) Changtam C, Hongmanee P, Suksamrarn A.Isoxazole analogs of curcuminoids with highly potent multidrug-resistant antimycobacterial activity.Eur J Med Chem. 2010 Oct;45(10):4446-57

Curator

KeyaMukherjee, vsheeba

Record - 11 of 13 [TOP]

Compound ID

3012

Compound Structure

Plant Source

Curcuma longa Common Name:Turmeric

Source Family

Zingiberaceae

Origin

Southeast Asia

Plant Part Used

Root

Extract

Target Bacteria

Mycobacterium tuberculosis M46 (MDR (Multi - drug - resistant) strains which are Isoniazid, Rifampin, Ethambutol, Streptomycin, Ofloxacin and Ciprofloxacin resistant)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Kanamycin (2.5 µg/ml), Isoniazid (0.06 µg/ml), Rifampin (0.004 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

1.56 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole (Pentylation on the other ring)

PubChem ID

Ethnomedicinal Information

PubMed ID [Source Literature]

20691508

Extract Preparation

Treatment with hydroxylamine hydrochloride in pyridin, HPLC, NMR analysis, shade - dried, ground and extracted

Chemical Classification [Active Compound]

Aromatic, Alkene, Curcuminoid, Isoxazole, Ether

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H9GC

Cytotoxicity Assay [AID]

Molecular Weight

435.205

Molecular Formula

C₂₆H₂₉NO₅

SMILES

C1c(c(ccc1/C=C/c1cc(/C=C/c2cc(c(cc2)OCCCCC)OC)on1)O)OC

XLogP

6.765

PSA

73.950

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) Changtam C, Hongmanee P, Suksamrarn A.Isoxazole analogs of curcuminoids with highly potent multidrug-resistant antimycobacterial activity.Eur J Med Chem. 2010 Oct;45(10):4446-57

Curator

KeyaMukherjee, vsheeba

Record - 12 of 13 [TOP]

Compound ID

3013

Compound Structure

Plant Source

Curcuma longa Common Name:Turmeric

Source Family

Zingiberaceae

Origin

Southeast Asia

Plant Part Used

Root

Extract

Target Bacteria

Mycobacterium tuberculosis M48 (MDR (Multi - drug - resistant) strains which are Isoniazid, Rifampin, Ethambutol, Streptomycin, Ofloxacin and Ciprofloxacin resistant)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Kanamycin (2.5 µg/ml), Isoniazid (0.06 µg/ml), Rifampin (0.004 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

3.125 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole (Pentylation on the other ring)

PubChem ID

Ethnomedicinal Information

PubMed ID [Source Literature]

20691508

Extract Preparation

Treatment with hydroxylamine hydrochloride in pyridin, HPLC, NMR analysis, shade - dried, ground and extracted

Chemical Classification [Active Compound]

Aromatic, Alkene, Curcuminoid, Isoxazole, Ether

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H9GC

Cytotoxicity Assay [AID]

Molecular Weight

435.205

Molecular Formula

C₂₆H₂₉NO₅

SMILES

C1c(c(ccc1/C=C/c1cc(/C=C/c2cc(c(cc2)OCCCCC)OC)on1)O)OC

XLogP

6.765

PSA

73.950

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) Changtam C, Hongmanee P, Suksamrarn A.Isoxazole analogs of curcuminoids with highly potent multidrug-resistant antimycobacterial activity.Eur J Med Chem. 2010 Oct;45(10):4446-57

Curator

KeyaMukherjee, vsheeba

Record - 13 of 13 [TOP]

Compound ID

3014

Compound Structure

Plant Source

Curcuma longa Common Name:Turmeric

Source Family

Zingiberaceae

Origin

Southeast Asia

Plant Part Used

Root

Extract

Target Bacteria

Mycobacterium tuberculosis M53 (MDR (Multi - drug - resistant) strains which are Isoniazid, Rifampin, Ethambutol, Streptomycin, Ofloxacin and Ciprofloxacin resistant)

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Kanamycin (2.5 µg/ml), Isoniazid (0.06 µg/ml), Rifampin (0.004 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

3.125 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole (Pentylation on the other ring)

PubChem ID

Ethnomedicinal Information

PubMed ID [Source Literature]

20691508

Extract Preparation

Treatment with hydroxylamine hydrochloride in pyridin, HPLC, NMR analysis, shade - dried, ground and extracted

Chemical Classification [Active Compound]

Aromatic, Alkene, Curcuminoid, Isoxazole, Ether

Media / Broth Used [Antimicrobial Assay/Test]

Middlebrook 7H9GC

Cytotoxicity Assay [AID]

Molecular Weight

435.205

Molecular Formula

C₂₆H₂₉NO₅

SMILES

C1c(c(ccc1/C=C/c1cc(/C=C/c2cc(c(cc2)OCCCCC)OC)on1)O)OC

XLogP

6.765

PSA

73.950

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) Changtam C, Hongmanee P, Suksamrarn A.Isoxazole analogs of curcuminoids with highly potent multidrug-resistant antimycobacterial activity.Eur J Med Chem. 2010 Oct;45(10):4446-57

Curator

KeyaMukherjee, vsheeba

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