BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP006516

(1R,3S,6S)-6-[(1E,3Z)-4-[(3R,8S,9R)-8-[(2E,4E,6E,8E,10E,12E)-13-[(4R)-4-hydroxy-2,6,6-trimethylcyclohexen-1-yl]-7,11-dimethyltrideca-2,4,6,8,10,12-hexaen-2-yl]-3,5,6-trimethyl-3-[(4R,8R)-4,8,12-trimethyltridecyl]-2,8,9,10-tetrahydro-1H-pyrano[3,2-f]chromen-9-yl]-3-methylbuta-1,3-dienyl]-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-3-ol

Formula: C69H104O5  |  Mol. Weight: 1013.60 g/mol

IUPAC: (1R,3S,6S)-6-[(1E,3Z)-4-[(3R,8S,9R)-8-[(2E,4E,6E,8E,10E,12E)-13-[(4R)-4-hydroxy-2,6,6-trimethylcyclohexen-1-yl]-7,11-dimethyltrideca-2,4,6,8,10,12-hexaen-2-yl]-3,5,6-trimethyl-3-[(4R,8R)-4,8,12-trimethyltridecyl]-2,8,9,10-tetrahydro-1H-pyrano[3,2-f]chromen-9-yl]-3-methylbuta-1,3-dienyl]-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-3-ol

3D View Find Similar

Overview

Molecular Formula C69H104O5
Molecular Weight 1013.60 g/mol
Canonical SMILES CC1=C(C(CC(C1)O)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C2C(CC3=C(O2)C(=C(C4=C3CCC(O4)(C)CCCC(C)CCCC(C)CCCC(C)C)C)C)C=C(C)C=CC56C(CC(CC5(O6)C)O)(C)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy