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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP012154

10-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxydeca-4,6-diynoic acid

Formula: C22H32O13  |  Mol. Weight: 504.50 g/mol

IUPAC: 10-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxydeca-4,6-diynoic acid

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Overview

Molecular Formula C22H32O13
Molecular Weight 504.50 g/mol
Canonical SMILES C(CC#CC#CCCC(=O)O)COC1C(C(C(C(O1)CO)O)O)OC2C(C(C(C(O2)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy