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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP026365

28-Homodolicholide

Formula: C29H48O6  |  Mol. Weight: 492.70 g/mol

IUPAC: (1S,2R,4R,5S,7S,11S,12S,15R,16S)-15-[(E,2S,3R,4R)-3,4-dihydroxy-5-propan-2-ylhept-5-en-2-yl]-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one

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Overview

Molecular Formula C29H48O6
Molecular Weight 492.70 g/mol
Canonical SMILES CC=C(C(C)C)C(C(C(C)C1CCC2C1(CCC3C2COC(=O)C4C3(CC(C(C4)O)O)C)C)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy