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Substance Name: Casticin
RN: 479-91-4
UNII: 753GT729OU
InChIKey: PJQLSMYMOKWUJG-UHFFFAOYSA-N

Note

  • From fruit of Vitex rotundifolia.

Molecular Formula

  • C19-H18-O8

Molecular Weight

  • 374.3432
 
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Names and Synonyms

Name of Substance

  • Casticin

Synonyms

  • 3',5-Dihydroxy-3,4',6,7-tetramethoxyflavone
  • UNII-753GT729OU
  • Vitexicarpin

Systematic Name

  • 4H-1-Benzopyran-4-one, 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxy-

Registry Numbers

CAS Registry Number

  • 479-91-4

FDA UNII

  • 753GT729OU

System Generated Number

  • 0000479914

Structure Descriptors

InChI

1S/C19H18O8/c1-23-11-6-5-9(7-10(11)20)17-19(26-4)16(22)14-12(27-17)8-13(24-2)18(25-3)15(14)21/h5-8,20-21H,1-4H3

InChIKey

PJQLSMYMOKWUJG-UHFFFAOYSA-N

Smiles

COC1=C(Oc2cc(OC)c(OC)c(O)c2C1=O)c3ccc(OC)c(O)c3