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                  Page - 1 of 1                  Record - 1 of 13   [TOP]
Compound ID2352
Compound Structure
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Plant SourcePiper auritum     Common Name:Eared Pepper, False Kava (Hawaii), False Kava - Kava, Hierba Santa, Hoja Santa
Source FamilyPiperaceae
OriginColombia
Plant Part UsedLeaf
ExtractEssential oil (2.3 %)
Target BacteriaMycobacterium tuberculosis H37Rv
Assay / Test DoneMacrodilution method in glass tubes
Positive Control Used (conc.)Rifampin (0.50 µg/ml), Isoniazid (0.03 µg/ml)
Inhibition [%]
Activity [MIC] µg/ml400 ± 220 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound IdentifiedMethyl eugenol
PubChem ID   7127
Ethnomedicinal InformationTuberculosis
PubMed ID [Source Literature]19753839
Extract PreparationN/A
Chemical Classification [Active Compound]Aromatic, Phenylpropanoid, Ether
Media / Broth Used [Antimicrobial Assay/Test]N/A
Cytotoxicity Assay [AID]N/A
Molecular Weight178.099
Molecular FormulaC11H14O2
SMILESO(c1cc(CC=C)ccc1OC)C
XLogP3.003
PSA18.460
H-bond Donor0
H-bond Acceptor2
No. of Rotatable Bond Count4
No. of Rings1
No. of N0
No. of O2
No. of S0
Reference(s)1) Bueno-Sánchez JG, Martínez-Morales JR, Stashenko EE, Ribón W.Anti-tubercular activity of eleven aromatic and medicinal plants occurring in Colombia.Biomedica. 2009 Mar;29(1):51-60

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                  Record - 2 of 13   [TOP]
Compound ID2386
Compound Structure
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Plant SourcePiper sarmentosum Roxb.     Common Name:Cha Plu
Source FamilyPiperaceae
OriginProbably Southeast Asia, Malaysia
Plant Part UsedFresh root
ExtractEthanol
Target BacteriaMycobacterium tuberculosis H37Ra
Assay / Test DoneMicroplate Alamar Blue Assay (MABA)
Positive Control Used (conc.)Isoniazid (0.04 - 0.09 µg/ml) and Kanamycin sulphate (2.0 - 5.0 µg/ml)
Inhibition [%]
Activity [MIC] µg/ml25 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound IdentifiedN - [9 - (3, 4 - Methylenedioxyphenyl) - 2E, 4E, 8E - Nonatrienoyl] Pyrrolidine
PubChem IDNR
Ethnomedicinal InformationCough, anti - tuberculosis and anti - plasmodial activities
PubMed ID [Source Literature]16462055
Extract PreparationThe fresh roots of Piper sarmentosum (481 g) were ground and extracted with 95 % EtOH at room temperature. After filtration and evaporation, the ethanolic extract was obtained as a brown viscous oil (19.4 g). The oil was partitioned between water (200 ml) and EtOAc (3 x 200 ml) and the water layer was further partitioned with n - BuOH (3 x 200 ml). Evaporation of the EtOAc-, n-BuOH- and water - soluble fractions gave a dark brown oil (6.3 g), a brown oil (1.8 g) and a light brown oil (10.5 g), respectively. The EtOAc - soluble fraction (6.3 g) was separated by flash column chromatography using silica gel
Chemical Classification [Active Compound]Aromatic, Alkene, Phenylpropanoid, Pyrrolidine, Amide, Ether
Media / Broth Used [Antimicrobial Assay/Test]N/A
Cytotoxicity Assay [AID]N/A
Molecular Weight325.168
Molecular FormulaC20H23NO3
SMILESC1c2c(ccc1/C=C/CC/C=C/C=C/C(=O)N1CCCC1)OCO2
XLogP4.569
PSA38.770
H-bond Donor0
H-bond Acceptor2
No. of Rotatable Bond Count7
No. of Rings3
No. of N1
No. of O3
No. of S0
Reference(s)1) Tuntiwachwuttikul P, Phansa P, Pootaeng-On Y, Taylor WC.Chemical constituents of the roots of Piper sarmentosum.Chem Pharm Bull (Tokyo). 2006 Feb;54(2):149-51

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                  Record - 3 of 13   [TOP]
Compound ID2826
Compound Structure
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Plant SourceZanthoxylum wutaiense     Common Name:
Source FamilyRutaceae
OriginChina
Plant Part UsedRoot, wood
Extract
Target BacteriaMycobacterium tuberculosis H37Rv
Assay / Test Done
Positive Control Used (conc.)
Inhibition [%]
Activity [MIC] µg/ml30 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound IdentifiedWutaiensal
PubChem ID   25015068
Ethnomedicinal InformationTuberculosis
PubMed ID [Source Literature]18564877
Extract PreparationN/A
Chemical Classification [Active Compound]Aromatic, Phenylpropanoid, Benzofuranoid, Aldehyde, Alcohol
Media / Broth Used [Antimicrobial Assay/Test]N/A
Cytotoxicity Assay [AID]N/A
Molecular Weight262.121
Molecular FormulaC15H18O4
SMILESO1[C@H](C(O)(C)C)Cc2c1c(OC)cc(c2)/C=C/C=O
XLogP1.873
PSA55.760
H-bond Donor1
H-bond Acceptor4
No. of Rotatable Bond Count4
No. of Rings2
No. of N0
No. of O4
No. of S0
Reference(s)1) Huang HY, Ishikawa T, Peng CF, Tsai IL, Chen IS.Constituents of the root wood of Zanthoxylum wutaiense with antitubercular activity.J Nat Prod. 2008 Jul;71(7):1146-51

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                  Record - 4 of 13   [TOP]
Compound ID3625
Compound Structure
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Plant SourcePiper sanctum (Miq.) Schl.     Common Name:
Source FamilyPiperaceae
OriginSouthcentral region of Mexico
Plant Part UsedLeaf
ExtractDichloromethane:Methanol (1:1)
Target BacteriaMycobacterium tuberculosis H37Rv
Assay / Test DoneMicroplate Alamar Blue Assay (MABA)
Positive Control Used (conc.)Rifampin (0.25 µg/ml)
Inhibition [%]
Activity [MIC] µg/ml64 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound IdentifiedZ - Piperolide
PubChem IDNR
Ethnomedicinal Information
PubMed ID [Source Literature]15620234
Extract Preparation
Chemical Classification [Active Compound]Aromatic, Phenylpropanoid, Ether
Media / Broth Used [Antimicrobial Assay/Test]
Cytotoxicity Assay [AID]Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay
Molecular Weight260.105
Molecular FormulaC15H16O4
SMILESO1/C(=C(/C=C/c2ccccc2)\OC)/C(CC1=O)OC
XLogP4.339
PSA44.760
H-bond Donor0
H-bond Acceptor4
No. of Rotatable Bond Count4
No. of Rings2
No. of N0
No. of O4
No. of S0
Reference(s)1) Mata R, Morales I, Pérez O, Rivero-Cruz I, Acevedo L, Enriquez-Mendoza I, Bye R, Franzblau S, Timmermann B.Antimycobacterial compounds from Piper sanctum.J Nat Prod. 2004 Dec;67(12):1961-8

CuratorRachana, Keyamukherjee, vikramjitmandal

                  Record - 5 of 13   [TOP]
Compound ID3629
Compound Structure
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Plant SourcePiper sanctum (Miq.) Schl.     Common Name:
Source FamilyPiperaceae
OriginSouthcentral region of Mexico
Plant Part UsedStem
ExtractDichloromethane:Methanol (1:1)
Target BacteriaMycobacterium tuberculosis H37Rv
Assay / Test DoneMicroplate Alamar Blue Assay (MABA)
Positive Control Used (conc.)Rifampin (0.25 µg/ml)
Inhibition [%]
Activity [MIC] µg/ml128 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound IdentifiedN - Trans - Feruloyltyramine
PubChem ID   5280537
Ethnomedicinal Information
PubMed ID [Source Literature]15620234
Extract Preparation
Chemical Classification [Active Compound]Aromatic, Phenylpropanoid, Amide, Phenol
Media / Broth Used [Antimicrobial Assay/Test]
Cytotoxicity Assay [AID]Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay
Molecular Weight313.131
Molecular FormulaC18H19NO4
SMILESO(c1cc(/C=C/C(=O)NCCc2ccc(O)cc2)ccc1O)C
XLogP2.691
PSA78.790
H-bond Donor3
H-bond Acceptor5
No. of Rotatable Bond Count7
No. of Rings2
No. of N1
No. of O4
No. of S0
Reference(s)1) Mata R, Morales I, Pérez O, Rivero-Cruz I, Acevedo L, Enriquez-Mendoza I, Bye R, Franzblau S, Timmermann B.Antimycobacterial compounds from Piper sanctum.J Nat Prod. 2004 Dec;67(12):1961-8

CuratorRachana, Keyamukherjee, vikramjitmandal

                  Record - 6 of 13   [TOP]
Compound ID3630
Compound Structure
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Plant SourcePiper sanctum (Miq.) Schl.     Common Name:
Source FamilyPiperaceae
OriginSouthcentral region of Mexico
Plant Part UsedStem
ExtractDichloromethane:Methanol (1:1)
Target BacteriaMycobacterium tuberculosis H37Rv
Assay / Test DoneMicroplate Alamar Blue Assay (MABA)
Positive Control Used (conc.)Rifampin (0.25 µg/ml)
Inhibition [%]
Activity [MIC] µg/ml32 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound IdentifiedN-trans-(p-coumaroyl)tyramine
PubChem IDNR
Ethnomedicinal Information
PubMed ID [Source Literature]15620234
Extract Preparation
Chemical Classification [Active Compound]Aromatic, Phenylpropanoid, Amide, Phenol
Media / Broth Used [Antimicrobial Assay/Test]
Cytotoxicity Assay [AID]Against Vero cells (ATCCCCL- 81) in the CellTiter 96 aqueous nonradioactive cell proliferation assay
Molecular Weight283.121
Molecular FormulaC17H17NO3
SMILESC1c(ccc(c1)/C=C/C(=O)NCCc1ccc(cc1)O)O
XLogP3.346
PSA69.560
H-bond Donor3
H-bond Acceptor4
No. of Rotatable Bond Count6
No. of Rings2
No. of N1
No. of O3
No. of S0
Reference(s)1) Mata R, Morales I, Pérez O, Rivero-Cruz I, Acevedo L, Enriquez-Mendoza I, Bye R, Franzblau S, Timmermann B.Antimycobacterial compounds from Piper sanctum.J Nat Prod. 2004 Dec;67(12):1961-8

CuratorRachana, Keyamukherjee, vikramjitmandal

                  Record - 7 of 13   [TOP]
Compound ID3729
Compound Structure
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Plant SourcePiper sarmentosum     Common Name:Cha Plu
Source FamilyPiperaceae
OriginThailand
Plant Part UsedFresh root
ExtractEthanol (95 %)
Target BacteriaMycobacterium tuberculosis H37Ra
Assay / Test DoneMicroplate Alamar Blue Assay (MABA)
Positive Control Used (conc.)Isoniazid (0.04 - 0.09 µg/ml) and Kanamycin sulphate (2.0 - 5.0 µg/ml)
Inhibition [%]NR
Activity [MIC] µg/ml> 200 µg/ml
Activity (In terms of dilution)NR
Activity (Zone of inhibition in mm)NR
Active Compound IdentifiedN - (3 - Phenylpropanoyl) Pyrrole
PubChem ID   11074385
Ethnomedicinal InformationNR
PubMed ID [Source Literature]16462055
Extract PreparationThe fresh roots of Piper sarmentosum (481 g) were ground and extracted with 95 % EtOH at room temperature. After filtration and evaporation, the ethanolic extract was obtained as a brown viscous oil (19.4 g). The oil was partitioned between water (200 ml) and EtOAc (3 x 200 ml) and the water layer was further partitioned with n - BuOH (3 x 200 ml). Evaporation of the EtOAc-, n-BuOH- and water - soluble fractions gave a dark brown oil (6.3 g), a brown oil (1.8 g) and a light brown oil (10.5 g), respectively. The EtOAc - soluble fraction (6.3 g) was separated by flash column chromatography using silica gel
Chemical Classification [Active Compound]Aromatic, Phenylpropanoid, Pyrrol, Amide
Media / Broth Used [Antimicrobial Assay/Test]NR
Cytotoxicity Assay [AID]NR
Molecular Weight199.100
Molecular FormulaC13H13NO
SMILESO=C(n1cccc1)CCc1ccccc1
XLogP4.579
PSA22.000
H-bond Donor0
H-bond Acceptor2
No. of Rotatable Bond Count4
No. of Rings2
No. of N1
No. of O1
No. of S0
Reference(s)1) Tuntiwachwuttikul P, Phansa P, Pootaeng-On Y, Taylor WC.Chemical constituents of the roots of Piper sarmentosum.Chem Pharm Bull (Tokyo). 2006 Feb;54(2):149-51

CuratorKeyaMukherjee, gppreetha

                  Record - 8 of 13   [TOP]
Compound ID3738
Compound Structure
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Plant SourcePiper sarmentosum     Common Name:Cha Plu
Source FamilyPiperaceae
OriginThailand
Plant Part UsedFresh root
ExtractEthanol (95 %)
Target BacteriaMycobacterium tuberculosis H37Ra
Assay / Test DoneMicroplate Alamar Blue Assay (MABA)
Positive Control Used (conc.)Isoniazid (0.04 - 0.09 µg/ml) and Kanamycin sulphate (2.0 - 5.0 µg/ml)
Inhibition [%]NR
Activity [MIC] µg/ml> 200 µg/ml
Activity (In terms of dilution)NR
Activity (Zone of inhibition in mm)NR
Active Compound IdentifiedSarmentamide A
PubChem ID   11528614
Ethnomedicinal InformationNR
PubMed ID [Source Literature]16462055
Extract PreparationThe fresh roots of Piper sarmentosum (481 g) were ground and extracted with 95 % EtOH at room temperature. After filtration and evaporation, the ethanolic extract was obtained as a brown viscous oil (19.4 g). The oil was partitioned between water (200 ml) and EtOAc (3 x 200 ml) and the water layer was further partitioned with n - BuOH (3 x 200 ml). Evaporation of the EtOAc-, n-BuOH- and water - soluble fractions gave a dark brown oil (6.3 g), a brown oil (1.8 g) and a light brown oil (10.5 g), respectively. The EtOAc - soluble fraction (6.3 g) was separated by flash column chromatography using silica gel
Chemical Classification [Active Compound]Aromatic, Phenylpropanoid, Pyrrolidone, Amide
Media / Broth Used [Antimicrobial Assay/Test]NR
Cytotoxicity Assay [AID]NR
Molecular Weight215.095
Molecular FormulaC13H13NO2
SMILESO=C(N1CC=CC1=O)CCc1ccccc1
XLogP3.518
PSA37.380
H-bond Donor0
H-bond Acceptor3
No. of Rotatable Bond Count4
No. of Rings2
No. of N1
No. of O2
No. of S0
Reference(s)1) Tuntiwachwuttikul P, Phansa P, Pootaeng-On Y, Taylor WC.Chemical constituents of the roots of Piper sarmentosum.Chem Pharm Bull (Tokyo). 2006 Feb;54(2):149-51

CuratorGppreetha

                  Record - 9 of 13   [TOP]
Compound ID3739
Compound Structure
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Plant SourcePiper sarmentosum     Common Name:Cha Plu
Source FamilyPiperaceae
OriginThailand
Plant Part UsedFresh root
ExtractEthanol (95 %)
Target BacteriaMycobacterium tuberculosis H37Ra
Assay / Test DoneMicroplate Alamar Blue Assay (MABA)
Positive Control Used (conc.)Isoniazid (0.04 - 0.09 µg/ml) and Kanamycin sulphate (2.0 - 5.0 µg/ml)
Inhibition [%]NR
Activity [MIC] µg/ml> 200 µg/ml
Activity (In terms of dilution)NR
Activity (Zone of inhibition in mm)NR
Active Compound IdentifiedSarmentamide B
PubChem IDNR
Ethnomedicinal InformationAntimycobacterial and antiplasmodial activity, antifungal
PubMed ID [Source Literature]16462055
Extract PreparationThe fresh roots of Piper sarmentosum (481 g) were ground and extracted with 95 % EtOH at room temperature. After filtration and evaporation, the ethanolic extract was obtained as a brown viscous oil (19.4 g). The oil was partitioned between water (200 ml) and EtOAc (3 x 200 ml) and the water layer was further partitioned with n - BuOH (3 x 200 ml). Evaporation of the EtOAc-, n-BuOH- and water - soluble fractions gave a dark brown oil (6.3 g), a brown oil (1.8 g) and a light brown oil (10.5 g), respectively. The EtOAc - soluble fraction (6.3 g) was separated by flash column chromatography using silica gel
Chemical Classification [Active Compound]Aromatic, Phenylpropanoid, Pyrrolidine, Amide, O-Acetyl
Media / Broth Used [Antimicrobial Assay/Test]NR
Cytotoxicity Assay [AID]NR
Molecular Weight285.136
Molecular FormulaC17H19NO3
SMILESO=C(/C=C/c1ccccc1)N1C[C@@H]([C@H](C1)C(=O)C)C(=O)C
XLogP2.976
PSA54.450
H-bond Donor0
H-bond Acceptor4
No. of Rotatable Bond Count5
No. of Rings2
No. of N1
No. of O3
No. of S0
Reference(s)1) Tuntiwachwuttikul P, Phansa P, Pootaeng-On Y, Taylor WC.Chemical constituents of the roots of Piper sarmentosum.Chem Pharm Bull (Tokyo). 2006 Feb;54(2):149-51

CuratorKeyaMukherjee, rachanake

                  Record - 10 of 13   [TOP]
Compound ID3740
Compound Structure
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Plant SourcePiper sarmentosum     Common Name:Cha Plu
Source FamilyPiperaceae
OriginThailand
Plant Part UsedFresh root
ExtractEthanol (95 %)
Target BacteriaMycobacterium tuberculosis H37Ra
Assay / Test DoneMicroplate Alamar Blue Assay (MABA)
Positive Control Used (conc.)Isoniazid (0.04 - 0.09 µg/ml) and Kanamycin sulphate (2.0 - 5.0 µg/ml)
Inhibition [%]NR
Activity [MIC] µg/ml> 200 µg/ml
Activity (In terms of dilution)NR
Activity (Zone of inhibition in mm)NR
Active Compound IdentifiedSarmentamide C
PubChem ID   11514809
Ethnomedicinal InformationAntimycobacterial and antiplasmodial activity, antifungal
PubMed ID [Source Literature]16462055
Extract PreparationThe fresh roots of Piper sarmentosum (481 g) were ground and extracted with 95 % EtOH at room temperature. After filtration and evaporation, the ethanolic extract was obtained as a brown viscous oil (19.4 g). The oil was partitioned between water (200 ml) and EtOAc (3 x 200 ml) and the water layer was further partitioned with n - BuOH (3 x 200 ml). Evaporation of the EtOAc-, n-BuOH- and water - soluble fractions gave a dark brown oil (6.3 g), a brown oil (1.8 g) and a light brown oil (10.5 g), respectively. The EtOAc - soluble fraction (6.3 g) was separated by flash column chromatography using silica gel
Chemical Classification [Active Compound]Aromatic, Alkene, Phenylpropanoid, Pyrrolidine, Amide, Ether
Media / Broth Used [Antimicrobial Assay/Test]NR
Cytotoxicity Assay [AID]NR
Molecular Weight291.147
Molecular FormulaC16H21NO4
SMILESO=C(N1CCCC1)/C=C/c1c(OC)cc(OC)c(OC)c1
XLogP1.744
PSA48.000
H-bond Donor0
H-bond Acceptor5
No. of Rotatable Bond Count6
No. of Rings2
No. of N1
No. of O4
No. of S0
Reference(s)1) Tuntiwachwuttikul P, Phansa P, Pootaeng-On Y, Taylor WC.Chemical constituents of the roots of Piper sarmentosum.Chem Pharm Bull (Tokyo). 2006 Feb;54(2):149-51

CuratorKeyaMukherjee, rachanake

                  Record - 11 of 13   [TOP]
Compound ID4072
Compound Structure
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Plant SourceCamchaya calcarea     Common Name:
Source FamilyAsteraceae (Compositae)
Origin
Plant Part Used
Extract
Target BacteriaMycobacterium tuberculosis H37Ra
Assay / Test Done
Positive Control Used (conc.)
Inhibition [%]
Activity [MIC] µg/ml25 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound IdentifiedEJMC168
PubChem IDNR
Ethnomedicinal Information
PubMed ID [Source Literature]
Extract Preparation
Chemical Classification [Active Compound]Aromatic, Alkene, Phenylpropanoid, Ester, Phenol
Media / Broth Used [Antimicrobial Assay/Test]
Cytotoxicity Assay [AID]
Molecular Weight194.058
Molecular FormulaC10H10O4
SMILESO=C(OC)/C=C/c1cc(O)c(O)cc1
XLogP1.462
PSA66.760
H-bond Donor2
H-bond Acceptor4
No. of Rotatable Bond Count3
No. of Rings1
No. of N0
No. of O4
No. of S0
Reference(s)1) In silico Comparison of Antimycobacterial Natural Products with Known Antituberculosis Drugs. Marlene Espinoza-Moraga, Nicholas M. Njuguna, Grace Mugumbate, Julio Caballero, and Kelly Chibale. Journal of Chemical Information and Modeling 2013 53 (3), 649-660

2) García, A., Bocanegra-García, V., Palma-Nicolás, J. P., Rivera, G. Vennerstrom, J. L. Recent Advances in Antitubercular Natural Products. Eur. J. Med. Chem. 2012, 49, 1-23

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                  Record - 12 of 13   [TOP]
Compound ID4149
Compound Structure
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Plant SourcePimpinella sp.     Common Name:
Source FamilyApiaceae (Umbelliferae)
Origin
Plant Part Used
Extract
Target BacteriaMycobacterium intracellulare, Mycobacterium smegmatis, Mycobacterium aurum, Mycobacterium phlei
Assay / Test Done
Positive Control Used (conc.)
Inhibition [%]
Activity [MIC] µg/ml1.25-10 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound IdentifiedNPMC10
PubChem IDNR
Ethnomedicinal Information
PubMed ID [Source Literature]
Extract Preparation
Chemical Classification [Active Compound]Aromatic, Phenylpropanoid, Epoxy
Media / Broth Used [Antimicrobial Assay/Test]
Cytotoxicity Assay [AID]
Molecular Weight248.141
Molecular FormulaC15H20O3
SMILESC[C@@H](CC)C(=O)Oc1ccc([C@@]2(C)O[C@@H]2C)cc1
XLogP3.891
PSA38.830
H-bond Donor0
H-bond Acceptor3
No. of Rotatable Bond Count5
No. of Rings2
No. of N0
No. of O3
No. of S0
Reference(s)1) In silico Comparison of Antimycobacterial Natural Products with Known Antituberculosis Drugs. Marlene Espinoza-Moraga, Nicholas M. Njuguna, Grace Mugumbate, Julio Caballero, and Kelly Chibale. Journal of Chemical Information and Modeling 2013 53 (3), 649-660

2) Rogoza, L. N.; Salakhutdinov, N. F.; Tolstikov, G. A. Anti-tubercular Activity of Natural Products: Recent Developments. In Opportunity, Challenge and Scope of Natural Products in Medicinal Chemistry; Tiwari, V. K. Ed.; Research Signpost: India, 2011; pp 103-120

Curator

                  Record - 13 of 13   [TOP]
Compound ID4150
Compound Structure
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Plant SourcePimpinella sp.     Common Name:
Source FamilyApiaceae (Umbelliferae)
Origin
Plant Part Used
Extract
Target BacteriaMycobacterium intracellulare, Mycobacterium smegmatis, Mycobacterium aurum, Mycobacterium phlei
Assay / Test Done
Positive Control Used (conc.)
Inhibition [%]
Activity [MIC] µg/ml1.25-10 µg/ml
Activity (In terms of dilution)
Activity (Zone of inhibition in mm)
Active Compound IdentifiedNPMC11
PubChem IDNR
Ethnomedicinal Information
PubMed ID [Source Literature]
Extract Preparation
Chemical Classification [Active Compound]Aromatic, Phenylpropanoid, Epoxy
Media / Broth Used [Antimicrobial Assay/Test]
Cytotoxicity Assay [AID]
Molecular Weight246.126
Molecular FormulaC15H18O3
SMILESC/C(=CC)/C(=O)Oc1ccc([C@@]2(C)O[C@@H]2C)cc1
XLogP3.773
PSA38.830
H-bond Donor0
H-bond Acceptor3
No. of Rotatable Bond Count4
No. of Rings2
No. of N0
No. of O3
No. of S0
Reference(s)1) In silico Comparison of Antimycobacterial Natural Products with Known Antituberculosis Drugs. Marlene Espinoza-Moraga, Nicholas M. Njuguna, Grace Mugumbate, Julio Caballero, and Kelly Chibale. Journal of Chemical Information and Modeling 2013 53 (3), 649-660

2) Rogoza, L. N.; Salakhutdinov, N. F.; Tolstikov, G. A. Anti-tubercular Activity of Natural Products: Recent Developments. In Opportunity, Challenge and Scope of Natural Products in Medicinal Chemistry; Tiwari, V. K. Ed.; Research Signpost: India, 2011; pp 103-120

Curator


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