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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP027362

[(8S,9S,10S,11R)-11-hexanoyloxy-9,14-dihydroxy-3,4,5,15,16-pentamethoxy-9,10-dimethyl-8-tricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaenyl] benzoate

Formula: C36H44O11  |  Mol. Weight: 652.70 g/mol

IUPAC: [(8S,9S,10S,11R)-11-hexanoyloxy-9,14-dihydroxy-3,4,5,15,16-pentamethoxy-9,10-dimethyl-8-tricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaenyl] benzoate

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Overview

Molecular Formula C36H44O11
Molecular Weight 652.70 g/mol
Canonical SMILES CCCCCC(=O)OC1C(C(C(C2=CC(=C(C(=C2C3=C(C(=C(C=C13)O)OC)OC)OC)OC)OC)OC(=O)C4=CC=CC=C4)(C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy