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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP032328

ent-Epicatechin-(2alpha->7,4alpha->8)-epicatechin 3-arabinoside

Formula: C35H32O16  |  Mol. Weight: 708.60 g/mol

IUPAC: (1S,5R,6R,13R,21S)-5,13-bis(3,4-dihydroxyphenyl)-21-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19-tetrol

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Overview

Molecular Formula C35H32O16
Molecular Weight 708.60 g/mol
Canonical SMILES C1C(C(OC2=C1C(=CC3=C2C4C(C(O3)(OC5=CC(=CC(=C45)O)O)C6=CC(=C(C=C6)O)O)OC7C(C(C(CO7)O)O)O)O)C8=CC(=C(C=C8)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy