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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007891

(2S,3R,4S,4aR,6aR,8aS,12aS,13S,14aR,14bR)-2,3-dihydroxy-13-(hydroxymethyl)-4,6a,11,11,14b-pentamethyl-2,3,4a,5,6,7,8,9,10,12,12a,13,14,14a-tetradecahydro-1H-picene-4,8a-dicarboxylic acid

Formula: C30H46O7  |  Mol. Weight: 518.70 g/mol

IUPAC: (2S,3R,4S,4aR,6aR,8aS,12aS,13S,14aR,14bR)-2,3-dihydroxy-13-(hydroxymethyl)-4,6a,11,11,14b-pentamethyl-2,3,4a,5,6,7,8,9,10,12,12a,13,14,14a-tetradecahydro-1H-picene-4,8a-dicarboxylic acid

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Overview

Molecular Formula C30H46O7
Molecular Weight 518.70 g/mol
Canonical SMILES CC1(CCC2(CCC3=C(C2C1)C(CC4C3(CCC5C4(CC(C(C5(C)C(=O)O)O)O)C)C)CO)C(=O)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy