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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP015267

(4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-9-(acetyloxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2S,3R,4S,5S)-3,4,5-triacetyloxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

Formula: C43H64O12  |  Mol. Weight: 773.00 g/mol

IUPAC: (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-9-(acetyloxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2S,3R,4S,5S)-3,4,5-triacetyloxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

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Overview

Molecular Formula C43H64O12
Molecular Weight 773.00 g/mol
Canonical SMILES CC(=O)OCC1(C2CCC3(C(C2(CCC1OC4C(C(C(CO4)OC(=O)C)OC(=O)C)OC(=O)C)C)CC=C5C3(CCC6(C5CC(CC6)(C)C)C(=O)O)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy