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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP008693

[(1R,2S,3R,4R,4aS,8aR)-2-benzoyloxy-3-hydroxy-3,4,8a-trimethyl-8-methylidene-4-[2-(5-oxo-2H-furan-3-yl)ethyl]-1,2,4a,5,6,7-hexahydronaphthalen-1-yl] benzoate

Formula: C34H38O7  |  Mol. Weight: 558.70 g/mol

IUPAC: [(1R,2S,3R,4R,4aS,8aR)-2-benzoyloxy-3-hydroxy-3,4,8a-trimethyl-8-methylidene-4-[2-(5-oxo-2H-furan-3-yl)ethyl]-1,2,4a,5,6,7-hexahydronaphthalen-1-yl] benzoate

Overview

Molecular Formula C34H38O7
Molecular Weight 558.70 g/mol
Canonical SMILES CC1(C2CCCC(=C)C2(C(C(C1(C)O)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)C)CCC5=CC(=O)OC5

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy