Chem
J-GLOBAL ID:200907004401731020
Nikkaji number:J444.991F
(+)-Hernandulcin
(+)-ヘルナンズルシン
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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:
C15 H24 O2
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
(6S)-6-[(2S)-2-ヒドロキシ-6-メチルヘプタ-5-エン-2-イル]-3-メチルシクロヘキサ-2-エン-1-オン
(6S)-6-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-3-methylcyclohex-2-en-1-one
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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
(+)-Hernandulcin
(4S)-1-Methyl-4α-[(S)-1-hydroxy-1,5-dimethyl-4-hexenyl]cyclohexene-3-one
3-Methyl-6β-((S)-1,5-dimethyl-1-hydroxy-4-hexenyl)-2-cyclohexene-1-one
(2S)-2-[(1S)-1-Hydroxy-1,5-dimethyl-4-hexenyl]-5-methyl-5-cyclohexene-1-one
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CAS registry number:
95602-94-1
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