Chem
J-GLOBAL ID：200907083753485417   Nikkaji number：J12.769H

Eseramine

エセラミン
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： C16H22N4O3
Molecular formula furigana： C16-H22-N4-O3
Molecular weight： 318.377
InChI： InChI=1S/C16H22N4O3/c1-16-7-8-20(14(21)17-2)13(16)19(4)12-6-5-10(9-11(12)16)23-15(22)18-3/h5-6,9,13H,7-8H2,1-4H3,(H,17,21)(H,18,22)/t13-,16-/m0/s1
InChI key： PYEMNABYODPRPP-BBRMVZONSA-N
SMILES： CNC(=O)Oc1ccc2N(C)[C@H]3N(CC[C@@]3(C)c2c1)C(=O)NC
Systematic name  (3)：
  • (3aS,8aS)-3,3a,8,8a-テトラヒドロ-N,3a,8-トリメチル-5-[(メチルカルバモイル)オキシ]ピロロ[2,3-b]インドール-1(2H)-カルボアミド
  • (3aS,8aS)-3a,8-ジメチル-1-(メチルカルバモイル)-1H,2H,3H,3aH,8H,8aH-ピロロ[2,3-b]インドール-5-イル N-メチルカルバマート
  • (3aS,8aS)-3a,8-dimethyl-1-(methylcarbamoyl)-1H,2H,3H,3aH,8H,8aH-pyrrolo[2,3-b]indol-5-yl N-methylcarbamate
Other name (3)：
  • エセラミン
  • Eseramine
  • (3aS,8aS)-3,3a,8,8a-Tetrahydro-N,3a,8-trimethyl-5-[(methylcarbamoyl)oxy]pyrrolo[2,3-b]indole-1(2H)-carboxamide
CAS registry number： 6091-57-2
KEGG COMPOUND： C09170
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