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Substance Name: Tigloylgomisin P
RN: 69176-51-8
UNII: 2VFX4QAR6A
InChIKey: BKGUPIVDQHHVMV-TWJXSMCESA-N

Molecular Formula

  • C28-H34-O9

Molecular Weight

  • 514.5676
 
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Names and Synonyms

Name of Substance

  • Tigloylgomisin P

Synonyms

  • 2-Butenoic acid, 2-methyl-, (5R,6R,7S,13aS)-5,6,7,8-tetrahydro-6-hydroxy-1,2,3,13-tetramethoxy-6,7-dimethylbenzo(3,4)cycloocta(1,2-f)(1,3)benzodioxol-5-yl ester, (2E)-
  • Tiglogomisin P
  • Tigloylgomisin P
  • UNII-2VFX4QAR6A

Registry Numbers

CAS Registry Number

  • 69176-51-8

FDA UNII

  • 2VFX4QAR6A

System Generated Number

  • 0069176518

Structure Descriptors

InChI

InChI=1S/C28H34O9/c1-9-14(2)27(29)37-26-17-12-18(31-5)22(32-6)25(34-8)21(17)20-16(10-15(3)28(26,4)30)11-19-23(24(20)33-7)36-13-35-19/h9,11-12,15,26,30H,10,13H2,1-8H3/b14-9+/t15-,26+,28+/m0/s1

InChIKey

BKGUPIVDQHHVMV-TWJXSMCESA-N

Smiles

COc1cc2[C@@H](OC(=O)\C(=C\C)\C)[C@](C)(O)[C@@H](C)Cc3cc4OCOc4c(OC)c3c2c(OC)c1OC