Chem
J-GLOBAL ID：200907000745540813   Nikkaji number：J2.459.263D

N,N-Dioctyl-β-valienamine

N,N-ジオクチルバリエナミン
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： C23H45NO4
Molecular formula furigana： C23-H45-N-O4
Molecular weight： 399.616
InChI： InChI=1S/C23H45NO4/c1-3-5-7-9-11-13-15-24(16-14-12-10-8-6-4-2)20-17-19(18-25)21(26)23(28)22(20)27/h17,20-23,25-28H,3-16,18H2,1-2H3/t20-,21+,22-,23-/m0/s1
InChI key： XHDNTGTWPXRGDT-BJESRGMDSA-N
SMILES： CCCCCCCCN(CCCCCCCC)[C@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (3)：
  • 6α-(ジオクチルアミノ)-4-(ヒドロキシメチル)-4-シクロヘキセン-1α,2β,3α-トリオール
  • (1S,2S,3R,6S)-6-(ジオクチルアミノ)-4-(ヒドロキシメチル)シクロヘキサ-4-エン-1,2,3-トリオール
  • (1S,2S,3R,6S)-6-(dioctylamino)-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol
Other name (3)：
  • 6α-(Dioctylamino)-4-(hydroxymethyl)-4-cyclohexene-1α,2β,3α-triol
  • N,N-ジオクチルバリエナミン
  • N,N-Dioctyl-β-valienamine
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Thesaurus Map

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