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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP001046

Card-20(22)-enolide, 3-[(2,6-dideoxy-I(2)-D-xylo-hexopyranosyl)oxy]-14-hydroxy-, (3I(2),5I(2))-

Formula: C29H44O7  |  Mol. Weight: 504.70 g/mol

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

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Overview

Molecular Formula C29H44O7
Molecular Weight 504.70 g/mol
Canonical SMILES CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy