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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP020565

Coffeasterene

Formula: C31H50O  |  Mol. Weight: 438.70 g/mol

IUPAC: (4Z)-4-ethylidene-10,13-dimethyl-17-[(E)-5-propan-2-ylhept-5-en-2-yl]-1,2,3,5,6,7,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol

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Overview

Molecular Formula C31H50O
Molecular Weight 438.70 g/mol
Canonical SMILES CC=C1C2CCC3=C(C2(CCC1O)C)CCC4(C3CCC4C(C)CCC(=CC)C(C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy