Chem
J-GLOBAL ID:200907004401731020   Nikkaji number:J444.991F

(+)-Hernandulcin

(+)-ヘルナンズルシン
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C15H24O2
Molecular formula furigana: C15-H24-O2
Molecular weight: 236.355
InChI: InChI=1S/C15H24O2/c1-11(2)6-5-9-15(4,17)13-8-7-12(3)10-14(13)16/h6,10,13,17H,5,7-9H2,1-4H3/t13-,15+/m1/s1
InChI key: HYQNKKAJVPMBDR-HIFRSBDPSA-N
SMILES: CC(=CCC[C@](C)(O)[C@@H]1CCC(=CC1=O)C)C
Systematic name  (7):
  • (S)-6β-[(S)-1-ヒドロキシ-1,5-ジメチル-4-ヘキセニル]-3-メチル-2-シクロヘキセン-1-オン
  • (S)-3-メチル-6β-[(S)-1-ヒドロキシ-1,5-ジメチル-4-ヘキセニル]-2-シクロヘキセン-1-オン
  • (4S)-1-メチル-4α-[(S)-1-ヒドロキシ-1,5-ジメチル-4-ヘキセニル]シクロヘキセン-3-オン
  • 3-メチル-6β-((S)-1,5-ジメチル-1-ヒドロキシ-4-ヘキセニル)-2-シクロヘキセン-1-オン
  • (2S)-2-[(1S)-1-ヒドロキシ-1,5-ジメチル-4-ヘキセニル]-5-メチル-5-シクロヘキセン-1-オン
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Other name (9):
  • ヘルナンズルシン
  • Hernandulcin
  • (S)-6β-[(S)-1-Hydroxy-1,5-dimethyl-4-hexenyl]-3-methyl-2-cyclohexen-1-one
  • (S)-3-Methyl-6β-[(S)-1-hydroxy-1,5-dimethyl-4-hexenyl]-2-cyclohexene-1-one
  • (+)-ヘルナンズルシン
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CAS registry number: 95602-94-1
KEGG COMPOUND: C09681
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