Chem
J-GLOBAL ID：201007031833521920   Nikkaji number：J2.793.894I

3β,4-Dimethyl-4-aza-5α-cholestane

3β,4-ジメチル-4-アザ-5α-コレスタン
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： C28H51N
Molecular formula furigana： C28-H51-N
Molecular weight： 401.723
InChI： InChI=1S/C28H51N/c1-19(2)9-8-10-20(3)23-12-13-24-22-11-14-26-28(6,17-15-21(4)29(26)7)25(22)16-18-27(23,24)5/h19-26H,8-18H2,1-7H3/t20-,21+,22+,23-,24+,25+,26-,27-,28-/m1/s1
InChI key： GWWAUGFEXKPHIM-OXKYWHGHSA-N
SMILES： CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4N(C)[C@@H](C)CC[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • 3β,4-ジメチル-4-アザ-5α-コレスタン
  • (2S,4aR,4bS,6aR,7R,9aS,9bS,11aR)-1,2,4a,6a-テトラメチル-7-[(2R)-6-メチルヘプタン-2-イル]-ヘキサデカヒドロ-1H-インデノ[5,4-f]キノリン
  • (2S,4aR,4bS,6aR,7R,9aS,9bS,11aR)-1,2,4a,6a-tetramethyl-7-[(2R)-6-methylheptan-2-yl]-hexadecahydro-1H-indeno[5,4-f]quinoline
Other name (1)：
  • 3β,4-Dimethyl-4-aza-5α-cholestane
KEGG COMPOUND： C15336
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