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Substance Name: Cimiracemate A
RN: 478294-16-5
UNII: P7969HTB05
InChIKey: BZBZUGSXRITWQR-QPJJXVBHSA-N

Note

  • Isolated from Cimicifuga racemosa.

Molecular Formula

  • C19-H18-O7

Molecular Weight

  • 358.3442
 
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Names and Synonyms

Name of Substance

  • Cimiracemate A

Synonyms

  • 2-Propenoic acid, 3-(3-hydroxy-4-methoxyphenyl)-, 3-(3,4-dihydroxyphenyl)-2-oxopropyl ester, (2E)-
  • 3,4-Dihydroxyphenyl-2-oxopropyl isoferulate
  • Cimiciphenol
  • Cimiracemate A
  • UNII-P7969HTB05

Registry Numbers

CAS Registry Number

  • 478294-16-5

FDA UNII

  • P7969HTB05

System Generated Number

  • 0478294165

Structure Descriptors

InChI

1S/C19H18O7/c1-25-18-6-3-12(9-17(18)23)4-7-19(24)26-11-14(20)8-13-2-5-15(21)16(22)10-13/h2-7,9-10,21-23H,8,11H2,1H3/b7-4+

InChIKey

BZBZUGSXRITWQR-QPJJXVBHSA-N

Smiles

COc1ccc(cc1O)/C=C/C(=O)OCC(=O)Cc2ccc(c(c2)O)O