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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP002450

(1S,3S,5S,7R,9S,11R)-11-[(2E)-3,7-dimethylocta-2,6-dienyl]-4,4,8,8-tetramethyl-9-(2-methylpropanoyl)-3-prop-1-en-2-yltetracyclo[7.3.1.17,11.01,5]tetradecane-10,12,13-trione

Formula: C35H50O4  |  Mol. Weight: 534.80 g/mol

IUPAC: (1S,3S,5S,7R,9S,11R)-11-[(2E)-3,7-dimethylocta-2,6-dienyl]-4,4,8,8-tetramethyl-9-(2-methylpropanoyl)-3-prop-1-en-2-yltetracyclo[7.3.1.17,11.01,5]tetradecane-10,12,13-trione

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Overview

Molecular Formula C35H50O4
Molecular Weight 534.80 g/mol
Canonical SMILES CC(C)C(=O)C12C(=O)C3(CC(C1(C)C)CC4C(C(CC4(C3=O)C2=O)C(=C)C)(C)C)CC=C(C)CCC=C(C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy