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Substance Name: Adhumulone
RN: 28374-89-2
InChIKey: VISQWZWNDCYFMY-UHFFFAOYSA-N

Molecular Formula

  • C21-H30-O5

Molecular Weight

  • 362.463
 
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Names and Synonyms

Results Name

  • Adhumulone

Synonym

  • Adhumulone

Systematic Name

  • 4-Cyclohexene-1,3-dione, 2,5-dihydroxy-2,6-bis(3-methyl-2-butenyl)-4-(2-methyl-1-oxobutyl)-

Registry Numbers

CAS Registry Number

  • 28374-89-2

System Generated Number

  • 0028374892

Structure Descriptors

InChI

1S/C21H30O5/c1-7-14(6)17(22)16-18(23)15(9-8-12(2)3)19(24)21(26,20(16)25)11-10-13(4)5/h8,10,14-15,23,26H,7,9,11H2,1-6H3

InChIKey

VISQWZWNDCYFMY-UHFFFAOYSA-N

Smiles

C1([C@@](C(C(=C([C@@H]1C\C=C(\C)C)O)C([C@@H](CC)C)=O)=O)(C\C=C(\C)C)O)=O