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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP002605

18I+/--Olean-12-en-29-oic acid, 3I(2),18,21I+/--trihydroxy-11-oxo-, I(3)-lactone, (-)-

Formula: C30H44O5  |  Mol. Weight: 484.70 g/mol

IUPAC: (1R,5R,6S,9S,11R,14R,15S,18S,20R,21S)-9,20-dihydroxy-6,10,10,14,15,18,21-heptamethyl-23-oxahexacyclo[19.2.1.01,18.02,15.05,14.06,11]tetracos-2-ene-4,22-dione

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Overview

Molecular Formula C30H44O5
Molecular Weight 484.70 g/mol
Canonical SMILES CC1(C2CCC3(C(C2(CCC1O)C)C(=O)C=C4C3(CCC5(C46CC(C(C5)O)(C(=O)O6)C)C)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy