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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP001157

[(1S,4R,5R,8R,10R,13R,14R,16R,17S,18S,19S,20R)-4,5,9,9,13,19,20-heptamethyl-23-oxo-24-oxahexacyclo[14.6.2.01,18.04,17.05,14.08,13]tetracosan-10-yl] benzoate

Formula: C37H52O4  |  Mol. Weight: 560.80 g/mol

IUPAC: [(1S,4R,5R,8R,10R,13R,14R,16R,17S,18S,19S,20R)-4,5,9,9,13,19,20-heptamethyl-23-oxo-24-oxahexacyclo[14.6.2.01,18.04,17.05,14.08,13]tetracosan-10-yl] benzoate

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Overview

Molecular Formula C37H52O4
Molecular Weight 560.80 g/mol
Canonical SMILES CC1CCC23CCC4(C(C2C1C)C(CC5C4(CCC6C5(CCC(C6(C)C)OC(=O)C7=CC=CC=C7)C)C)OC3=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy