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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007747

(2R,3R,4S,5R)-2-[[(3S,4R,4aR,6aR,6aS,6bR,8aR,10R,12aR,14bS)-3,4,10-trihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen-4a-yl]methoxy]oxane-3,4,5-triol

Formula: C35H58O8  |  Mol. Weight: 606.80 g/mol

IUPAC: (2R,3R,4S,5R)-2-[[(3S,4R,4aR,6aR,6aS,6bR,8aR,10R,12aR,14bS)-3,4,10-trihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen-4a-yl]methoxy]oxane-3,4,5-triol

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Overview

Molecular Formula C35H58O8
Molecular Weight 606.80 g/mol
Canonical SMILES CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C(C1O)O)COC6C(C(C(CO6)O)O)O)C)C)(C)C)O)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy