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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP019200

coumaroyl(3-OMe)(-3)Sorf(a2-1a)Glc

Formula: C22H30O14  |  Mol. Weight: 518.50 g/mol

IUPAC: [(2S,3S,4R,5S)-4-hydroxy-2,5-bis(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-3-yl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

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Overview

Molecular Formula C22H30O14
Molecular Weight 518.50 g/mol
Canonical SMILES COC1=C(C=CC(=C1)C=CC(=O)OC2C(C(OC2(CO)OC3C(C(C(C(O3)CO)O)O)O)CO)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy