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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP017404

(2I+/-,3I+/-,4I(2))-2,3-Dihydroxyurs-12-en-23-oic acid

Formula: C30H48O4  |  Mol. Weight: 472.70 g/mol

IUPAC: (2R,3S,4R,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-2,3-dihydroxy-4,6a,6b,8a,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picene-4-carboxylic acid

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Overview

Molecular Formula C30H48O4
Molecular Weight 472.70 g/mol
Canonical SMILES CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C(=O)O)O)O)C)C)C2C1C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy