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Substance Name: Tigloylgomisin O
RN: 130855-74-2
UNII: 48F9D29682
InChIKey: PLKFSXFJGNZAER-VDJLVHAZSA-N

Molecular Formula

  • C28-H34-O8

Molecular Weight

  • 498.5686
 
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Names and Synonyms

Name of Substance

  • Tigloylgomisin O

Synonyms

  • 2-Butenoic acid, 2-methyl-, (5R,6S,7S)-5,6,7,8-tetrahydro-1,2,3,13-tetramethoxy-6,7-dimethylbenzo(3,4)cycloocta(1,2-f)(1,3)benzodioxol-5-yl ester, (2E)-
  • Tigloylgomisin O
  • UNII-48F9D29682

Registry Numbers

CAS Registry Number

  • 130855-74-2

FDA UNII

  • 48F9D29682

System Generated Number

  • 0130855742

Structure Descriptors

InChI

1S/C28H34O8/c1-9-14(2)28(29)36-23-16(4)15(3)10-17-11-20-25(35-13-34-20)26(32-7)21(17)22-18(23)12-19(30-5)24(31-6)27(22)33-8/h9,11-12,15-16,23H,10,13H2,1-8H3/b14-9+/t15-,16-,23+/m0/s1

InChIKey

PLKFSXFJGNZAER-VDJLVHAZSA-N

Smiles

C/C=C(\C)/C(=O)O[C@H]1c2cc(c(c(c2-c3c(cc4c(c3OC)OCO4)C[C@@H]([C@@H]1C)C)OC)OC)OC