Chem
J-GLOBAL ID：200907022795524545
Nikkaji number：J1.071.445A
A-2E
A-2E
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
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
Molecular formula： C42H58[N+]O
Molecular formula furigana： C42-H58-N-O
Molecular weight： 592.931
InChI：
InChI=1S/C42H58NO/c1-32(20-22-39-35(4)17-12-25-41(39,6)7)14-10-16-34(3)30-38-31-37(24-27-43(38)28-29-44)19-11-15-33(2)21-23-40-36(5)18-13-26-42(40,8)9/h10-11,14-16,19-24,27,30-31,44H,12-13,17-18,25-26,28-29H2,1-9H3/q+1/b16-10+,19-11+,22-20+,23-21+,32-14+,33-15+,34-30+
InChI key：
WPWFMRDPTDEJJA-FAXVYDRBSA-N
SMILES：
C/C(=C\C=C\C(=C\c1cc(/C=C/C=C(\C)/C=C/C2=C(C)CCCC2(C)C)cc[n+]1CCO)\C)/C=C/C1=C(C)CCCC1(C)C
Systematic name (8)：
- 1-(2-ヒドロキシエチル)-2-[(1E,3E,5E,7E)-2,6-ジメチル-8-(2,6,6-トリメチル-1-シクロヘキセニル)-1,3,5,7-オクタテトラエニル]-4-[(1E,3E,5E)-4-メチル-6-(2,6,6-トリメチル-1-シクロヘキセニル)-1,3,5-ヘキサトリエニル]ピリジニウム
- 2-[(1E,3E,5E,7E)-2,6-ジメチル-8-(2,6,6-トリメチル-1-シクロヘキセニル)-1,3,5,7-オクタテトラエニル]-4-[(1E,3E,5E)-4-メチル-6-(2,6,6-トリメチル-1-シクロヘキセニル)-1,3,5-ヘキサトリエニル]-1-(2-ヒドロキシエチル)ピリジニウム
- 2-[(1E,3E,5E,7E)-2,6-ジメチル-8-(2,6,6-トリメチル-1-シクロヘキセニル)-1,3,5,7-オクタテトラエニル]-4-[(1E,3E,5E)-4-メチル-6-(2,6,6-トリメチル-1-シクロヘキセニル)-1,3,5-ヘキサトリエニル]ピリジニウム-1-エタノール
- 2-[(1E,3E,5E,7E)-8-(2,6,6-トリメチル-1-シクロヘキセニル)-2,6-ジメチル-1,3,5,7-オクタテトラエニル]-4-[(1E,3E,5E)-6-(2,6,6-トリメチル-1-シクロヘキセニル)-4-メチル-1,3,5-ヘキサトリエニル]-1-(2-ヒドロキシエチル)ピリジニウム
- 1-(2-ヒドロキシエチル)-2-[(1E,3E,5E,7E)-8-(2,6,6-トリメチルシクロヘキセン-1-イル)-2,6-ジメチル-1,3,5,7-オクタテトラエニル]-4-[(1E,3E,5E)-6-(2,6,6-トリメチルシクロヘキセン-1-イル)-4-メチル-1,3,5-ヘキサトリエニル]ピリジニウム
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- 1-(2-Hydroxyethyl)-2-[(1E,3E,5E,7E)-2,6-dimethyl-8-(2,6,6-trimethyl-1-cyclohexenyl)-1,3,5,7-octatetrenyl]-4-[(1E,3E,5E)-4-methyl-6-(2,6,6-trimethyl-1-cyclohexenyl)-1,3,5-hexatrienyl]pyridinium
- A-2E
- N-レチニリデン-N-レチニルエタノールアミン
- N-Retinylidene-N-retinylethanolamine
- N-レニチル-N-レチニリデンエタノールアミン
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