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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP036369

[(2R,4aS,6aS,8aR,10R,12aS,14aS,14bR)-10-acetyloxy-2,4a,6a,9,9,12a,14a-heptamethyl-7-oxo-3,4,5,6,8,8a,10,11,12,13,14,14b-dodecahydro-1H-picen-2-yl]methyl acetate

Formula: C34H52O5  |  Mol. Weight: 540.80 g/mol

IUPAC: [(2R,4aS,6aS,8aR,10R,12aS,14aS,14bR)-10-acetyloxy-2,4a,6a,9,9,12a,14a-heptamethyl-7-oxo-3,4,5,6,8,8a,10,11,12,13,14,14b-dodecahydro-1H-picen-2-yl]methyl acetate

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Overview

Molecular Formula C34H52O5
Molecular Weight 540.80 g/mol
Canonical SMILES CC(=O)OCC1(CCC2(CCC3(C4=C(CCC3(C2C1)C)C5(CCC(C(C5CC4=O)(C)C)OC(=O)C)C)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy