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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP037320

(1aR,3S,4aS,7S,8aS)-7-hydroxy-3-[(1S,2R,3R)-2-(2-hydroxyethyl)-2-methyl-3-[(2R)-6-methylheptan-2-yl]cyclopentyl]-4a-methyl-2,3,5,6,7,8-hexahydro-1aH-naphtho[4,4a-b]oxiren-4-one

Formula: C27H46O4  |  Mol. Weight: 434.70 g/mol

IUPAC: (1aR,3S,4aS,7S,8aS)-7-hydroxy-3-[(1S,2R,3R)-2-(2-hydroxyethyl)-2-methyl-3-[(2R)-6-methylheptan-2-yl]cyclopentyl]-4a-methyl-2,3,5,6,7,8-hexahydro-1aH-naphtho[4,4a-b]oxiren-4-one

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Overview

Molecular Formula C27H46O4
Molecular Weight 434.70 g/mol
Canonical SMILES CC(C)CCCC(C)C1CCC(C1(C)CCO)C2CC3C4(O3)CC(CCC4(C2=O)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy