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Substance Name: Oxypaeoniflora
RN: 39011-91-1
UNII: 3A7O4NBD5S
InChIKey: FCHVXNVDFYXLIL-WRJNSLSBSA-N

Note

  • From Paeonia lactiflora.

Molecular Formula

  • C23-H28-O12

Molecular Weight

  • 496.4622
 
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Names and Synonyms

Name of Substance

  • Oxypaeoniflora

Synonyms

  • Oxypaeoniflorin
  • UNII-3A7O4NBD5S

Systematic Name

  • beta-D-Glucopyranoside, tetrahydro-5-hydroxy-5b-(((4-hydroxybenzoyl)oxy)methyl)-2-methyl-2,5-methano-1H-3,4-dioxacyclobuta(cd)pentalen-1a(2H)-yl, (1aR-(1aalpha,2beta,3aalpha,5alpha,5aalpha,5balpha))-

Registry Numbers

CAS Registry Number

  • 39011-91-1

FDA UNII

  • 3A7O4NBD5S

System Generated Number

  • 0039011911

Structure Descriptors

InChI

1S/C23H28O12/c1-20-8-22(30)13-6-23(20,33-18-16(28)15(27)14(26)12(7-24)32-18)21(13,19(34-20)35-22)9-31-17(29)10-2-4-11(25)5-3-10/h2-5,12-16,18-19,24-28,30H,6-9H2,1H3/t12-,13-,14-,15+,16-,18+,19-,20+,21+,22-,23+/m1/s1

InChIKey

FCHVXNVDFYXLIL-WRJNSLSBSA-N

Smiles

C[C@@]12C[C@@]3(O)O[C@@H](O1)[C@]4(COC(=O)c5ccc(O)cc5)[C@H]3C[C@]24O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O