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Substance Name: 8-epi-Xanthatin
RN: 30890-35-8
UNII: 8DFW6D5G55
InChIKey: RBRPTFMVULVGIC-MDKNCZOUSA-N

Molecular Formula

  • C15-H18-O3

Molecular Weight

  • 246.3042
 
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Names and Synonyms

Name of Substance

  • 8-epi-Xanthatin

Synonyms

  • (+)-8-epi-Xanthatin
  • 2H-Cyclohepta(b)furan-2-one, 3,3a,4,7,8,8a-hexahydro-7-methyl-3-methylene-6-((1E)-3-oxo-1-buten-1-yl)-, (3aR,7S,8aR)-
  • 2H-Cyclohepta(b)furan-2-one, 3,3a,4,7,8,8a-hexahydro-7-methyl-3-methylene-6-(3-oxo-1-butenyl)-, (3aR,6(E),7S,8aR)-
  • 2H-Cyclohepta(b)furan-2-one, 3,3a,4,7,8,8a-hexahydro-7-methyl-3-methylene-6-(3-oxo-1-butenyl)-, (3ar-(3aalpha,6(E),7beta,8aalpha))-
  • 8-epi-Xanthatin
  • UNII-8DFW6D5G55

Registry Numbers

CAS Registry Number

  • 30890-35-8

FDA UNII

  • 8DFW6D5G55

System Generated Number

  • 0030890358

Structure Descriptors

InChI

1S/C15H18O3/c1-9-8-14-13(11(3)15(17)18-14)7-6-12(9)5-4-10(2)16/h4-6,9,13-14H,3,7-8H2,1-2H3/b5-4+/t9-,13+,14+/m0/s1

InChIKey

RBRPTFMVULVGIC-MDKNCZOUSA-N

Smiles

C[C@H]1C[C@@H]2[C@H](CC=C1/C=C/C(=O)C)C(=C)C(=O)O2