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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP011696

[(2R,4S,5R,6R)-5-acetyloxy-2,6,10,10-tetramethyl-7-[(E)-3-phenylprop-2-enoyl]oxy-11-oxatricyclo[7.2.1.01,6]dodecan-4-yl] (E)-3-phenylprop-2-enoate

Formula: C35H40O7  |  Mol. Weight: 572.70 g/mol

IUPAC: [(2R,4S,5R,6R)-5-acetyloxy-2,6,10,10-tetramethyl-7-[(E)-3-phenylprop-2-enoyl]oxy-11-oxatricyclo[7.2.1.01,6]dodecan-4-yl] (E)-3-phenylprop-2-enoate

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Overview

Molecular Formula C35H40O7
Molecular Weight 572.70 g/mol
Canonical SMILES CC1CC(C(C2(C13CC(CC2OC(=O)C=CC4=CC=CC=C4)C(O3)(C)C)C)OC(=O)C)OC(=O)C=CC5=CC=CC=C5

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy