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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP000935

(2S,3R,4S,5S,6R)-2-(4,8-dihydroxy-6-methylnaphthalen-1-yl)oxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-3,4,5-triol

Formula: C22H28O12  |  Mol. Weight: 484.40 g/mol

IUPAC: (2S,3R,4S,5S,6R)-2-(4,8-dihydroxy-6-methylnaphthalen-1-yl)oxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-3,4,5-triol

Overview

Molecular Formula C22H28O12
Molecular Weight 484.40 g/mol
Canonical SMILES CC1=CC2=C(C=CC(=C2C(=C1)O)OC3C(C(C(C(O3)COC4C(C(C(CO4)O)O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy