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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP001980

Neoisoastilbin

Formula: C21H22O11  |  Mol. Weight: 450.40 g/mol

IUPAC: (2S,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3-dihydrochromen-4-one

Overview

Molecular Formula C21H22O11
Molecular Weight 450.40 g/mol
Canonical SMILES CC1C(C(C(C(O1)OC2C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy