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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP031686

Bauhiniaside B

Formula: C22H26O9  |  Mol. Weight: 434.40 g/mol

IUPAC: 1-[2-hydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(4-methoxyphenyl)propan-1-one

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Overview

Molecular Formula C22H26O9
Molecular Weight 434.40 g/mol
Canonical SMILES COC1=CC=C(C=C1)CCC(=O)C2=C(C=C(C=C2)OC3C(C(C(C(O3)CO)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy