Theaflavic acid

CAS Registry Number®

30407-93-3

CAS Name

Theaflavic acid

Molecular Formula

C21H16O10

Molecular Mass

428.35

Cite this Page

Theaflavic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=30407-93-3 (retrieved 2025-04-24) (CAS RN: 30407-93-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C21H16O10/c22-8-3-12(23)11-6-15(26)20(31-16(11)4-8)10-5-14(25)19(28)17-9(10)1-7(21(29)30)2-13(24)18(17)27/h1-5,15,20,22-23,25-26,28H,6H2,(H,24,27)(H,29,30)/t15-,20+/s2

InChIKey

InChIKey=SDSXQESYQIRNNR-VIHIFUDJNA-N

SMILES

OC1=C2C(=C(C=C1O)[C@H]3OC=4C(C[C@@H]3O)=C(O)C=C(O)C4)C=C(C(O)=O)C=C(O)C2=O

Canonical SMILES

O=C(O)C=1C=C(O)C(=O)C2=C(O)C(O)=CC(=C2C1)C3OC=4C=C(O)C=C(O)C4CC3O

Other Names for this Substance

  • 5H-Benzocycloheptene-8-carboxylic acid, 1-[(2R,3S)-3,4-dihydro-3,5,7-trihydroxy-2H-1-benzopyran-2-yl]-3,4,6-trihydroxy-5-oxo-, rel-
  • 5H-Benzocycloheptene-8-carboxylic acid, 1-(3,4-dihydro-3,5,7-trihydroxy-2H-1-benzopyran-2-yl)-3,4,6-trihydroxy-5-oxo-, trans-
  • 5H-Benzocycloheptene-8-carboxylic acid, 3,4,6-trihydroxy-5-oxo-1-(3,5,7-trihydroxy-2-chromanyl)-, trans-
  • rel-1-[(2R,3S)-3,4-Dihydro-3,5,7-trihydroxy-2H-1-benzopyran-2-yl]-3,4,6-trihydroxy-5-oxo-5H-benzocycloheptene-8-carboxylic acid
  • Theaflavic acid

CAS INSIGHTSTM
Illustration of microRNA (ribonucleic acid) molecules. MicroRNAs