BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP008431

(1S,1'S,2S,2'S,5S,5'R,8'R,9S,9'S,10'S,11'R,12R,13S,14S,15R,15'S,18'R,19S,22R)-9',10',13,14,15',18',19,22-octahydroxy-12',12',16,16-tetramethylspiro[10,21-dioxahexacyclo[11.6.2.15,12.01,15.02,12.06,11]docos-6(11)-ene-9,6'-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane]-7'-one

Formula: C40H56O12  |  Mol. Weight: 728.90 g/mol

IUPAC: (1S,1'S,2S,2'S,5S,5'R,8'R,9S,9'S,10'S,11'R,12R,13S,14S,15R,15'S,18'R,19S,22R)-9',10',13,14,15',18',19,22-octahydroxy-12',12',16,16-tetramethylspiro[10,21-dioxahexacyclo[11.6.2.15,12.01,15.02,12.06,11]docos-6(11)-ene-9,6'-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane]-7'-one

3D View Find Similar

Overview

Molecular Formula C40H56O12
Molecular Weight 728.90 g/mol
Canonical SMILES CC1(CCC(C23C1C(C(C45C2CCC(C4O)C6=C5OC7(CC6)C8CCC9C12COC(C9(C8O)C7=O)(C(C1C(CCC2O)(C)C)O)O)(OC3)O)O)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy