BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP013949

(2S,3R,4S,5R,6R)-2-[2-[(2R,4aS,7S)-4a-methyl-8-methylidene-7-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]propan-2-yloxy]-6-methyloxane-3,4,5-triol

Formula: C27H46O11  |  Mol. Weight: 546.60 g/mol

IUPAC: (2S,3R,4S,5R,6R)-2-[2-[(2R,4aS,7S)-4a-methyl-8-methylidene-7-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]propan-2-yloxy]-6-methyloxane-3,4,5-triol

3D View Find Similar

Overview

Molecular Formula C27H46O11
Molecular Weight 546.60 g/mol
Canonical SMILES CC1C(C(C(C(O1)OC(C)(C)C2CCC3(CCC(C(=C)C3C2)OC4C(C(C(C(O4)CO)O)O)O)C)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy