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Substance Name: Cimiracemate B
RN: 478294-17-6
UNII: 2SU4LF1JGS
InChIKey: AOAGZRJZUKYLHH-QPJJXVBHSA-N

Note

  • A phenylpropanoid found in Cimicifuga racemosa.

Molecular Formula

  • C19-H18-O7

Molecular Weight

  • 358.3442
 
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Names and Synonyms

Name of Substance

  • Cimiracemate B

Synonyms

  • 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, 3-(3,4-dihydroxyphenyl)-2-oxopropyl ester, (2E)-
  • Cimiracemate B
  • UNII-2SU4LF1JGS

Registry Numbers

CAS Registry Number

  • 478294-17-6

FDA UNII

  • 2SU4LF1JGS

System Generated Number

  • 0478294176

Structure Descriptors

InChI

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

InChIKey

AOAGZRJZUKYLHH-QPJJXVBHSA-N

Smiles

COc1cc(ccc1O)/C=C/C(=O)OCC(=O)Cc2ccc(c(c2)O)O