BioPhytMol: A database of Phytomolecules against Mycobacteria

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Page - 1 of 4 Record - 1 of 88 [TOP]

Compound ID	1153
Compound Structure
Plant Source	Alpinia galanga (L.) Sw. Common Name:Galanga (English)
Source Family	Zingiberaceae
Origin	Malaysia
Plant Part Used	Leaf
Extract	Methanol
Target Bacteria	Mycobacterium tuberculosis H37Rv
Assay / Test Done	Colorimetric Tetrazolium Microplate Assay (TEMA)
Positive Control Used (conc.)	Isoniazid (0.078 µg/ml)
Inhibition [%]
Activity [MIC] µg/ml	1600 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound Identified
PubChem ID	NR
Ethnomedicinal Information	Bronchitis
PubMed ID [Source Literature]
Extract Preparation	N/A
Chemical Classification [Active Compound]	N/A
Media / Broth Used [Antimicrobial Assay/Test]	N/A
Cytotoxicity Assay [AID]	N/A
Reference(s)	1) Anonymous, 2010c. Khazanah herba warisan bumi: Portal Komuniti Herba 2) Http://www.melur.com/myherba.asp?plant id=94
Curator

Record - 2 of 88 [TOP]

Compound ID	1156
Compound Structure
Plant Source	Alpinia Kumatake Mak. Common Name:
Source Family	Zingiberaceae
Origin	China
Plant Part Used
Extract	Alcohol
Target Bacteria	Mycobacterium tuberculosis
Assay / Test Done
Positive Control Used (conc.)
Inhibition [%]
Activity [MIC] µg/ml
Activity (In terms of dilution)	1:50 dilution
Activity (Zone of inhibition in mm)
Active Compound Identified
PubChem ID	NR
Ethnomedicinal Information	Treatment of flatulence (gas), dyspepsia (stomach upset), vomiting, high blood pressure, gastrointestinal complaints and sea sickness
PubMed ID [Source Literature]	14778141
Extract Preparation	N/A
Chemical Classification [Active Compound]	N/A
Media / Broth Used [Antimicrobial Assay/Test]	N/A
Cytotoxicity Assay [AID]	N/A
Reference(s)	1) Wang VF.In vitro antibacterial activity of some common Chinese herbs on Mycobacteria tuberculosis.Chin Med J. 1950 May-Jun;68(5-6):169-72 2) http://www.healthline.com/natstandardcontent/alpinia
Curator

Record - 3 of 88 [TOP]

Compound ID	1543
Compound Structure
Plant Source	Costus sp. Common Name:
Source Family	Zingiberaceae
Origin	Peru
Plant Part Used	Rhizome
Extract	Dichloromethane
Target Bacteria	Mycobacterium tuberculosis (ATCC 27294)
Assay / Test Done	BACTEC 460 (Becton Dickinson Diagnostic Instrument Systems, Sparks MD) Radiometric Assay
Positive Control Used (conc.)	Rifampin (2 µg/ml), Ethambutol (7.5 µg/ml)
Inhibition [%]	< 50 %
Activity [MIC] µg/ml	50 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound Identified
PubChem ID	NR
Ethnomedicinal Information	Tuberculosis
PubMed ID [Source Literature]	13678239
Extract Preparation	N/A
Chemical Classification [Active Compound]	N/A
Media / Broth Used [Antimicrobial Assay/Test]	N/A
Cytotoxicity Assay [AID]	N/A
Reference(s)	1) Graham JG, Pendland SL, Prause JL, Danzinger LH, Schunke Vigo J, Cabieses F, Farnsworth NR.Antimycobacterial evaluation of Peruvian plants.Phytomedicine. 2003;10(6-7):528-35
Curator

Record - 4 of 88 [TOP]

Compound ID	1577
Compound Structure
Plant Source	Curcuma domesticata Valeton syn. Curcuma longa L. Common Name:Turmeric (English), Haridraa, Priyaka, Haridruma, Kshanda, Gauri (Sanskrit)
Source Family	Zingiberaceae
Origin	India
Plant Part Used	Leaf
Extract	Water
Target Bacteria	Mycobacterium tuberculosis
Assay / Test Done	Broth Dilution Assay
Positive Control Used (conc.)
Inhibition [%]
Activity [MIC] µg/ml
Activity (In terms of dilution)	< 1:40 dilution
Activity (Zone of inhibition in mm)
Active Compound Identified
PubChem ID	NR
Ethnomedicinal Information	Bronchitis, leprosy, random screening
PubMed ID [Source Literature]	17276637
Extract Preparation	N/A
Chemical Classification [Active Compound]	N/A
Media / Broth Used [Antimicrobial Assay/Test]	N/A
Cytotoxicity Assay [AID]	N/A
Reference(s)	1) Gautam R, Saklani A, Jachak SM.Indian medicinal plants as a source of antimycobacterial agents.J Ethnopharmacol. 2007 Mar 21;110(2):200-34 2) Jain, S.K., Tarafder, C.R., 1970. Medicinal plant lore of the Santals. A revival of P.O. Boddings, work. Economic Botany 24, 241–278
Curator

Record - 5 of 88 [TOP]

Compound ID	1578
Compound Structure
Plant Source	Curcuma domesticata Valeton syn. Curcuma longa L. Common Name:Turmeric (English), Haridraa, Priyaka, Haridruma, Kshanda, Gauri (Sanskrit)
Source Family	Zingiberaceae
Origin	India
Plant Part Used	Mother tinture
Extract	Ethanol (95 %)
Target Bacteria	Mycobacterium tuberculosis H37Rv (human)
Assay / Test Done	Tube Dilution Test
Positive Control Used (conc.)
Inhibition [%]
Activity [MIC] µg/ml
Activity (In terms of dilution)	1:80 dilution
Activity (Zone of inhibition in mm)
Active Compound Identified
PubChem ID	NR
Ethnomedicinal Information	Bronchitis, leprosy, random screening
PubMed ID [Source Literature]	2118130
Extract Preparation	N/A
Chemical Classification [Active Compound]	N/A
Media / Broth Used [Antimicrobial Assay/Test]	N/A
Cytotoxicity Assay [AID]	N/A
Reference(s)	1) Grange JM, Davey RW.Detection of antituberculous activity in plant extracts.J Appl Bacteriol. 1990 Jun;68(6):587-91 2) Jain, S.K., Tarafder, C.R., 1970. Medicinal plant lore of the Santals. A revival of P.O. Boddings, work. Economic Botany 24, 241–278
Curator

Record - 6 of 88 [TOP]

Compound ID	1606
Compound Structure
Plant Source	Dimerocostus sp. Common Name:
Source Family	Zingiberaceae
Origin	Peru
Plant Part Used	Leaf
Extract	Dichloromethane
Target Bacteria	Mycobacterium tuberculosis (ATCC 27294)
Assay / Test Done	BACTEC 460 (Becton Dickinson Diagnostic Instrument Systems, Sparks MD) Radiometric Assay
Positive Control Used (conc.)	Rifampin (2 µg/ml), Ethambutol (7.5 µg/ml)
Inhibition [%]	56 %
Activity [MIC] µg/ml	50 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound Identified
PubChem ID	NR
Ethnomedicinal Information	Tuberculosis
PubMed ID [Source Literature]	13678239
Extract Preparation	N/A
Chemical Classification [Active Compound]	N/A
Media / Broth Used [Antimicrobial Assay/Test]	N/A
Cytotoxicity Assay [AID]	N/A
Reference(s)	1) Graham JG, Pendland SL, Prause JL, Danzinger LH, Schunke Vigo J, Cabieses F, Farnsworth NR.Antimycobacterial evaluation of Peruvian plants.Phytomedicine. 2003;10(6-7):528-35
Curator

Record - 7 of 88 [TOP]

Compound ID

1971

Compound Structure

Plant Source

Kaempferia parviflora Common Name:Krachai Dhum

Source Family

Zingiberaceae

Origin

Asia

Plant Part Used

Extract

Target Bacteria

Mycobacterium tuberculosis

Assay / Test Done

Microplate Alamar Blue Assay (MABA)

Positive Control Used (conc.)

Inhibition [%]

Activity [MIC] µg/ml

200 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

3, 5, 7, 4' - Tetramethoxyflavone

PubChem ID

631095

Ethnomedicinal Information

Anti-mycobacterial

PubMed ID [Source Literature]

14693228

Extract Preparation

N/A

Chemical Classification [Active Compound]

Aromatic, Tricyclic, Flavonoid, Ether

Media / Broth Used [Antimicrobial Assay/Test]

N/A

Cytotoxicity Assay [AID]

Against KB (oral human epidermoid carcinoma), BC (breast cancer), and NCI-H187 (human, small cell lung cancer) cell lines

Molecular Weight

342.110

Molecular Formula

C₁₉H₁₈O₆

SMILES

O1c2c(c(=O)c(OC)c1c1ccc(OC)cc1)c(OC)cc(OC)c2

XLogP

3.059

PSA

53.990

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)

1) Yenjai C, Prasanphen K, Daodee S, Wongpanich V, Kittakoop P.Bioactive flavonoids from Kaempferia parviflora.Fitoterapia. 2004 Jan;75(1):89-92

Curator

Record - 8 of 88 [TOP]

Compound ID

1972

Compound Structure

Plant Source

Kaempferia parviflora Common Name:Krachai Dhum

Source Family

Zingiberaceae

Origin

Asia

Plant Part Used

Extract

Target Bacteria

Mycobacterium tuberculosis

Assay / Test Done

Positive Control Used (conc.)

Isoniazid (0.040 – 0.090 µg/ml), Kanamycin sulfate (2.0 – 5.0 µg/ml)

Inhibition [%]

Activity [MIC] µg/ml

50 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

5, 7, 4` - Trimethoxyflavone

PubChem ID

79730

Ethnomedicinal Information

Anti-mycobacterial

PubMed ID [Source Literature]

14693228

Extract Preparation

N/A

Chemical Classification [Active Compound]

Aromatic, Tricyclic, Flavonoid, Ether

Media / Broth Used [Antimicrobial Assay/Test]

N/A

Cytotoxicity Assay [AID]

Against KB (oral human epidermoid carcinoma), BC (breast cancer), and NCI-H187 (human, small cell lung cancer) cell lines

Molecular Weight

312.100

Molecular Formula

C₁₈H₁₆O₅

SMILES

O1c2c(c(OC)cc(OC)c2)c(=O)cc1c1ccc(OC)cc1

XLogP

2.683

PSA

44.760

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) Yenjai C, Prasanphen K, Daodee S, Wongpanich V, Kittakoop P.Bioactive flavonoids from Kaempferia parviflora.Fitoterapia. 2004 Jan;75(1):89-92

Curator

Record - 9 of 88 [TOP]

Compound ID	2487
Compound Structure
Plant Source	Renealmia sp. Common Name:
Source Family	Zingiberaceae
Origin	Peru
Plant Part Used	Rhizome, leaf
Extract	Dichloromethane
Target Bacteria	Mycobacterium tuberculosis (ATCC 27294)
Assay / Test Done	BACTEC 460 (Becton Dickinson Diagnostic Instrument Systems, Sparks MD) radiometric assay
Positive Control Used (conc.)	Rifampin (2 µg/ml), Ethambutol (7.5 µg/ml)
Inhibition [%]	< 51 %
Activity [MIC] µg/ml	50 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound Identified
PubChem ID	NR
Ethnomedicinal Information	Tuberculosis
PubMed ID [Source Literature]	13678239
Extract Preparation	N/A
Chemical Classification [Active Compound]	N/A
Media / Broth Used [Antimicrobial Assay/Test]	N/A
Cytotoxicity Assay [AID]	N/A
Reference(s)	1) Graham JG, Pendland SL, Prause JL, Danzinger LH, Schunke Vigo J, Cabieses F, Farnsworth NR.Antimycobacterial evaluation of Peruvian plants.Phytomedicine. 2003;10(6-7):528-35
Curator

Record - 10 of 88 [TOP]

Compound ID	2831
Compound Structure
Plant Source	Zingiber officinale Rosc. Common Name:Ginger (English), Fresh Rhizome - Aardraka, Aadrikaa, Shrngibera (Sanskrit)
Source Family	Zingiberaceae
Origin	India, Malaysia
Plant Part Used	Rhizome
Extract	Dichloromethane
Target Bacteria	Mycobacterium tuberculosis, Mycobacterium avium
Assay / Test Done	Radiorespirometric Bioassay
Positive Control Used (conc.)
Inhibition [%]	85 %
Activity [MIC] µg/ml	100 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound Identified
PubChem ID	NR
Ethnomedicinal Information	Leprosy, expectorant, asthma, bronchitis, cough, phthisis, tuberculosis
PubMed ID [Source Literature]
Extract Preparation	N/A
Chemical Classification [Active Compound]	N/A
Media / Broth Used [Antimicrobial Assay/Test]	N/A
Cytotoxicity Assay [AID]	N/A
Reference(s)	1) R.D. Hiserodt,S.G. Franzblau and R.T. Rosen.Isolation of 6-, 8-, and 10-Gingerol from Ginger Rhizome by HPLC and Preliminary Evaluation of Inhibition of Mycobacterium avium and Mycobacterium tuberculosis.J. Agric. Food Chem., 1998, 46 (7), pp 2504–2508 2) Kirtikar, K.R., Basu, B.D., 1935. Indian Medicinal Plants, vols. 1–4. Lalit Mohan Basu, Allahabad, India 3) Jain, S.K., Tarafder, C.R., 1970. Medicinal plant lore of the Santals. A revival of P.O. Boddings, work. Economic Botany 24, 241–278
Curator

Record - 11 of 88 [TOP]

Compound ID

2833

Compound Structure

Plant Source

Zingiber officinale Rosc. Common Name:Ginger (English), Fresh Rhizome - Aardraka, Aadrikaa, Shrngibera (Sanskrit)

Source Family

Zingiberaceae

Origin

India, Malaysia

Plant Part Used

Rhizome

Extract

Dichloromethane

Target Bacteria

Mycobacterium tuberculosis

Assay / Test Done

Radiorespirometric Bioassay

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

10 - Gingerol

PubChem ID

168115

Ethnomedicinal Information

Leprosy, expectorant, asthma, bronchitis, cough, phthisis, tuberculosis

PubMed ID [Source Literature]

Extract Preparation

N/A

Chemical Classification [Active Compound]

Aromatic, Alkyl, Ketone, Ether, Phenol, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

N/A

Cytotoxicity Assay [AID]

N/A

Molecular Weight

350.246

Molecular Formula

C₂₁H₃₄O₄

SMILES

O[C@@H](CCCCCCCCC)CC(=O)CCc1cc(OC)c(O)cc1

XLogP

5.163

PSA

66.760

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) R.D. Hiserodt,S.G. Franzblau and R.T. Rosen.Isolation of 6-, 8-, and 10-Gingerol from Ginger Rhizome by HPLC and Preliminary Evaluation of Inhibition of Mycobacterium avium and Mycobacterium tuberculosis.J. Agric. Food Chem., 1998, 46 (7), pp 2504–2508

2) Kirtikar, K.R., Basu, B.D., 1935. Indian Medicinal Plants, vols. 1–4. Lalit Mohan Basu, Allahabad, India

3) Jain, S.K., Tarafder, C.R., 1970. Medicinal plant lore of the Santals. A revival of P.O. Boddings, work. Economic Botany 24, 241–278.

Curator

Record - 12 of 88 [TOP]

Compound ID

2834

Compound Structure

Plant Source

Zingiber officinale Rosc. Common Name:Ginger (English), Fresh Rhizome - Aardraka, Aadrikaa, Shrngibera (Sanskrit)

Source Family

Zingiberaceae

Origin

India, Malaysia

Plant Part Used

Rhizome

Extract

Dichloromethane

Target Bacteria

Mycobacterium avium

Assay / Test Done

Radiorespirometric Bioassay

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

10 - Gingerol

PubChem ID

168115

Ethnomedicinal Information

Leprosy, expectorant, asthma, bronchitis, cough, phthisis, tuberculosis

PubMed ID [Source Literature]

Extract Preparation

N/A

Chemical Classification [Active Compound]

Aromatic, Alkyl, Ketone, Ether, Phenol, Alcohol

Media / Broth Used [Antimicrobial Assay/Test]

N/A

Cytotoxicity Assay [AID]

N/A

Molecular Weight

350.246

Molecular Formula

C₂₁H₃₄O₄

SMILES

O[C@@H](CCCCCCCCC)CC(=O)CCc1cc(OC)c(O)cc1

XLogP

5.163

PSA

66.760

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

Record - 13 of 88 [TOP]

Compound ID

2835

Compound Structure

Plant Source

Zingiber officinale Rosc. Common Name:Ginger (English), Fresh Rhizome - Aardraka, Aadrikaa, Shrngibera (Sanskrit)

Source Family

Zingiberaceae

Origin

India, Malaysia

Plant Part Used

Rhizome

Extract

Dichloromethane

Target Bacteria

Mycobacterium tuberculosis

Assay / Test Done

Radiorespirometric Bioassay

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

8 - Gingerol

PubChem ID

5275725

Ethnomedicinal Information

Leprosy, expectorant, asthma, bronchitis, cough, phthisis, tuberculosis

PubMed ID [Source Literature]

Extract Preparation

N/A

Chemical Classification [Active Compound]

Aromatic, Alkyl, Ketone, Ether, Alcohol, Phenol

Media / Broth Used [Antimicrobial Assay/Test]

N/A

Cytotoxicity Assay [AID]

N/A

Molecular Weight

322.214

Molecular Formula

C₁₉H₃₀O₄

SMILES

OC(CCCCCCC)CC(=O)CCc1cc(OC)c(O)cc1

XLogP

4.025

PSA

66.760

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

Record - 14 of 88 [TOP]

Compound ID

2836

Compound Structure

Plant Source

Zingiber officinale Rosc. Common Name:Ginger (English), Fresh Rhizome - Aardraka, Aadrikaa, Shrngibera (Sanskrit)

Source Family

Zingiberaceae

Origin

India, Malaysia

Plant Part Used

Rhizome

Extract

Dichloromethane

Target Bacteria

Mycobacterium tuberculosis

Assay / Test Done

Radiorespirometric Bioassay

Positive Control Used (conc.)

Inhibition [%]

Activity [MIC] µg/ml

> 100 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

6 - Gingerol

PubChem ID

3473

Ethnomedicinal Information

Leprosy, expectorant, asthma, bronchitis, cough, phthisis, tuberculosis

PubMed ID [Source Literature]

Extract Preparation

N/A

Chemical Classification [Active Compound]

Alicyclic, Butenolide, Lactone, Alkene

Media / Broth Used [Antimicrobial Assay/Test]

N/A

Cytotoxicity Assay [AID]

N/A

Molecular Weight

294.183

Molecular Formula

C₁₇H₂₆O₄

SMILES

OC(CCCCC)CC(=O)CCc1cc(OC)c(O)cc1

XLogP

2.887

PSA

66.760

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

Record - 15 of 88 [TOP]

Compound ID	2837
Compound Structure
Plant Source	Zingiber officinale Rosc. Common Name:Ginger (English), Fresh Rhizome - Aardraka, Aadrikaa, Shrngibera (Sanskrit)
Source Family	Zingiberaceae
Origin	India, Malaysia
Plant Part Used	Rhizome
Extract	Methanol
Target Bacteria	Mycobacterium tuberculosis H37Rv
Assay / Test Done	Colorimetric Tetrazolium Microplate Assay (TEMA)
Positive Control Used (conc.)	Isoniazid (0.078 µg/ml)
Inhibition [%]
Activity [MIC] µg/ml	1600 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound Identified	N/A
PubChem ID	NR
Ethnomedicinal Information	Leprosy, expectorant, asthma, bronchitis, cough, phthisis, tuberculosis
PubMed ID [Source Literature]	21094237
Extract Preparation	N/A
Chemical Classification [Active Compound]	N/A
Media / Broth Used [Antimicrobial Assay/Test]	N/A
Cytotoxicity Assay [AID]	N/A
Reference(s)	1) Mohamad S, Zin NM, Wahab HA, Ibrahim P, Sulaiman SF, Zahariluddin AS, Noor SS.Antituberculosis potential of some ethnobotanically selected Malaysian plants.J Ethnopharmacol. 2011 Feb 16;133(3):1021-6
Curator

Record - 16 of 88 [TOP]

Compound ID	2838
Compound Structure
Plant Source	Zingiber officinale Rosc. Common Name:Ginger (English), Fresh Rhizome - Aardraka, Aadrikaa, Shrngibera (Sanskrit)
Source Family	Zingiberaceae
Origin	India, Malaysia
Plant Part Used	Rhizome
Extract	Methylene chloride
Target Bacteria
Assay / Test Done	BACTEC Assay
Positive Control Used (conc.)
Inhibition [%]	85 %
Activity [MIC] µg/ml	100 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound Identified	N/A
PubChem ID	NR
Ethnomedicinal Information	Leprosy, expectorant, asthma, bronchitis, cough, phthisis, tuberculosis
PubMed ID [Source Literature]	21094237
Extract Preparation	N/A
Chemical Classification [Active Compound]	N/A
Media / Broth Used [Antimicrobial Assay/Test]	N/A
Cytotoxicity Assay [AID]	N/A
Reference(s)	1) Mohamad S, Zin NM, Wahab HA, Ibrahim P, Sulaiman SF, Zahariluddin AS, Noor SS.Antituberculosis potential of some ethnobotanically selected Malaysian plants.J Ethnopharmacol. 2011 Feb 16;133(3):1021-6
Curator

Record - 17 of 88 [TOP]

Compound ID

2863

Compound Structure

Plant Source

Curcuma longa Common Name:Turmeric

Source Family

Zingiberaceae

Origin

Southeast Asian countries

Plant Part Used

Dried rhizome

Extract

Target Bacteria

Mycobacterium tuberculosis H37Rv

Assay / Test Done

Positive Control Used (conc.)

Inhibition [%]

Activity [MIC] µg/ml

1961 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Demethoxycurcumin

PubChem ID

5324476

Ethnomedicinal Information

Folk medicine, Antioxidant, anti - HIV, antimutagenic, antiangiogenic, antimalarial, antitubercular, antiandrogenic, COX inhibitory activities

PubMed ID [Source Literature]

20027668

Extract Preparation

Chemical Classification [Active Compound]

Aromatic, Alkene, Curcuminoid, Ether, Phenol

Media / Broth Used [Antimicrobial Assay/Test]

Cytotoxicity Assay [AID]

Molecular Weight

338.115

Molecular Formula

C₂₀H₁₈O₅

SMILES

O(c1cc(ccc1O)/C=C/C(=C/C(=O)/C=C/c1ccc(O)cc1)/O)C

XLogP

3.610

PSA

86.990

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)

1) Agrawal DK, Mishra PK.Curcumin and its analogues: potential anticancer agents.Med Res Rev. 2010 Sep;30(5):818-60

Curator

Reshmi

Record - 18 of 88 [TOP]

Compound ID

2989

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

0.39 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole

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, Phenol

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)O)OC)on1)OCCCCC)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

Lekha Raveendran, wvarsha

Record - 19 of 88 [TOP]

Compound ID

2990

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 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

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, Phenol

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)O)OC)on1)OCCCCC)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

Wvarsha, Lekha Raveendran

Record - 20 of 88 [TOP]

Compound ID

2991

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

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, Phenol

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)O)OC)on1)OCCCCC)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

Wvarsha, vsheeba

Record - 21 of 88 [TOP]

Compound ID

2992

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

0.78 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole

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, Phenol

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)O)OC)on1)OCCCCC)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

Wvarsha, vsheeba

Record - 22 of 88 [TOP]

Compound ID

2993

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

3.125 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole

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, Phenol

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)O)OC)on1)OCCCCC)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

Wvarsha, vsheeba

Record - 23 of 88 [TOP]

Compound ID

2994

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

3.125 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole

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, Phenol

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)O)OC)on1)OCCCCC)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

Wvarsha, vsheeba

Record - 24 of 88 [TOP]

Compound ID

2995

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

1.25 µg/spot

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole

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, Phenol

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)O)OC)on1)OCCCCC)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

Wvarsha, vsheeba

Record - 25 of 88 [TOP]

Compound ID

2996

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

3.125 µg/ml

Activity (In terms of dilution)

Activity (Zone of inhibition in mm)

Active Compound Identified

Mono - Pentoxy - Curcumin Isoxazole

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, Phenol

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)O)OC)on1)OCCCCC)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

Wvarsha, vsheeba

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