Bioactivity of Indian Medicinal Plants

SCFBio, IIT Delhi

SCFBio, IIT Delhi Hauz Khas, New Delhi

BIMP

Compound BIMP019674

(3R,5S,8S,9S,10R,13S,14S,17R)-3-hydroxy-17-[(1S)-1-(3-hydroxy-5-methylpyridin-2-yl)ethyl]-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one

Formula: C₂₇H₃₉NO₃ | Mol. Weight: 425.60 g/mol

IUPAC: (3R,5S,8S,9S,10R,13S,14S,17R)-3-hydroxy-17-[(1S)-1-(3-hydroxy-5-methylpyridin-2-yl)ethyl]-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one

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Overview

Molecular Formula C₂₇H₃₉NO₃

Molecular Weight 425.60 g/mol

Canonical SMILES CC1=CC(=C(N=C1)C(C)C2CCC3C2(CCC4C3CC(=O)C5C4(CCC(C5)O)C)C)O

Bioactivity of Indian Medicinal Plants

(3R,5S,8S,9S,10R,13S,14S,17R)-3-hydroxy-17-[(1S)-1-(3-hydroxy-5-methylpyridin-2-yl)ethyl]-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one

Overview

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

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