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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP003147

[(1S,4S,5R,8R,10S,13S,14R,17S,18R)-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-en-10-yl] (Z)-hexadec-9-enoate

Formula: C46H76O3  |  Mol. Weight: 677.10 g/mol

IUPAC: [(1S,4S,5R,8R,10S,13S,14R,17S,18R)-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-en-10-yl] (Z)-hexadec-9-enoate

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Overview

Molecular Formula C46H76O3
Molecular Weight 677.10 g/mol
Canonical SMILES CCCCCCC=CCCCCCCCC(=O)OC1CCC2(C(C1(C)C)CCC3(C2C=CC45C3(CCC6(C4CC(CC6)(C)C)CO5)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy