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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP032565

9-Dehydrohecogenin

Formula: C27H40O4  |  Mol. Weight: 428.60 g/mol

IUPAC: (1S,2S,4S,5'R,6R,7S,8R,9S,13S,16S,18S)-16-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-11-ene-6,2'-oxane]-10-one

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Overview

Molecular Formula C27H40O4
Molecular Weight 428.60 g/mol
Canonical SMILES CC1CCC2(C(C3C(O2)CC4C3(C(=O)C=C5C4CCC6C5(CCC(C6)O)C)C)C)OC1

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy