Baicalin

Molecule SVG Image

Properties Simple | Detailed

Formula C21H19O11+
IUPAC Name (2s,3s,4s,5r,6s)-6-(5,6-dihydroxy-4-oxo-2-phenyl-chromen-7-yl)oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
Molecular Mass 447.369 g·mol−1
Heat of Formation -1440.7 ± 16.7 kJ·mol−1
Dipole Moment 6.76 ± 1.08 D
Volume 466.68 Å 3
Surface Area 404.91 Å 2
Point Group Symmetry C1
Synonyms
  • (2s,3s,4s,5r,6s)-6-(5,6-dihydroxy-4-keto-2-phenyl-chromen-7-yl)oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
  • (2s,3s,4s,5r,6s)-6-(5,6-dihydroxy-4-oxo-2-phenyl-chromen-7-yl)oxy-3,4,5-trihydroxy-oxane-2-carboxylic acid
  • (2s,3s,4s,5r,6s)-6-(5,6-dihydroxy-4-oxo-2-phenyl-chromen-7-yl)oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
  • (2s,3s,4s,5r,6s)-6-(5,6-dihydroxy-4-oxo-2-phenylchromen-7-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
  • (2s,3s,4s,5r,6s)-6-[(5,6-dihydroxy-4-oxo-2-phenyl-7-chromenyl)oxy]-3,4,5-trihydroxy-2-tetrahydropyrancarboxylic acid
  • 5,6,7-trihydroxyflavone-7-o-.beta.-d-glucopyranosideuronic 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
  • 7-d-glucuronic acid-5,6-dihydroxyflavone
  • baicalein 7-o-glucuronide
  • baicalein-7-d-glucuronide
  • beta-d-glucopyranosiduronic acid, 5,6-dihydroxy-4-oxo-2-phenyl-4h-1-benzopyran-7-yl
  • tjn-151
CAS Number(s)
  • 31564-28-0
  • 100647-26-5
  • 21967-41-9
  • 27462-75-5
InChIKey IKIIZLYTISPENI-ZFORQUDYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O