Chemical Compound

Baicalin

CAS Registry Number 21967-41-9
Baicalin chemical structure
Primary Record

Baicalin

In stock
9,207 g
Purity
98.9 %
CAS
21967-41-9

Compound Identifiers & Properties

CAS
21967-41-9
PubChem CID
13654833
SMILES
C1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)O[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O)O
Canonical SMILES
O=C(O)[C@H]1O[C@H](Oc2cc3oc(-c4ccccc4)cc(=O)c3c(O)c2O)[C@H](O)[C@@H](O)[C@@H]1O

Names & Synonyms

  • Baicalin
  • Baicalein 7-O-glucuronide
  • SCHEMBL285081
  • Baicalin (NSC-661431)
  • CHEMBL513948
  • HMS3884H11
  • ZINC34114798
  • CID 13654833
  • AKOS022168217
  • CCG-269190
  • 7-D-Glucuronic acid-5,6-dihydroxyflavone
  • N1778
  • S2269
  • 21967-41-9
  • 5,6,7-trihydroxyflavone 7-O-beta-D-glucuronide
  • BRD-K99455969-001-02-8
  • (2S,3S,4S,5R,6R)-6-(5,6-dihydroxy-4-oxo-2-phenylchromen-7-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
  • 5,6-dihydroxy-4-oxo-2-phenyl-4H-1-benzopyran-7-yl beta-D-glucopyranosiduronic acid
  • 5,6-dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yl beta-D-glucopyranosiduronic acid
  • (2S,3S,4S,5R,6R)-6-[(5,6-dihydroxy-4-oxo-2-phenylchromen-7-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid