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Substance Name: Isocohumulone
RN: 25269-20-9
UNII: SJG442JA93
InChIKey: KKXFYHZSOIALRM-UHFFFAOYSA-N

Molecular Formula

  • C20-H28-O5

Molecular Weight

  • 348.436
 
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Names and Synonyms

Results Name

  • Isocohumulone

Name of Substance

  • Isocohumulone

Synonyms

  • EINECS 246-780-8
  • Isocohumulone
  • UNII-SJG442JA93

Systematic Name

  • 3,4-Dihydroxy-5-(3-methylbut-2-enyl)-4-(4-methyl-1-oxopent-3-enyl)-2-(2-methyl-1-oxopropyl)cyclopent-2-en-1-one

Registry Numbers

CAS Registry Number

  • 25269-20-9

FDA UNII

  • SJG442JA93

Other Registry Numbers

  • 17812-72-5
  • 510-16-7

System Generated Number

  • 0025269209

Structure Descriptors

InChI

1S/C20H28O5/c1-11(2)7-9-14-18(23)16(17(22)13(5)6)19(24)20(14,25)15(21)10-8-12(3)4/h7-8,13-14,24-25H,9-10H2,1-6H3

InChIKey

KKXFYHZSOIALRM-UHFFFAOYSA-N

Smiles

C1(=C([C@@](C(C\C=C(/C)C)=O)(O)[C@@H](C1=O)C\C=C(/C)C)O)C(=O)C(C)C