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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP036560

Shengmanol xyloside

Formula: C35H56O9  |  Mol. Weight: 620.80 g/mol

IUPAC: (2S,3R,4S,5R)-2-[[(4R,5R,6R,8R,10S,11R,12S,21R)-8-[(2S)-3,3-dimethyloxiran-2-yl]-10,11-dihydroxy-4,6,12,17,17-pentamethyl-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-18-yl]oxy]oxane-3,4,5-triol

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Overview

Molecular Formula C35H56O9
Molecular Weight 620.80 g/mol
Canonical SMILES CC1CC(OC2(C1C3(CCC45CC46CCC(C(C6CCC5C3(C2O)C)(C)C)OC7C(C(C(CO7)O)O)O)C)O)C8C(O8)(C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy