Chem
J-GLOBAL ID：200907076767332579   Nikkaji number：J1.850.435I

Purmorphamine

プルモルファミン
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： C31H32N6O2
Molecular formula furigana： C31-H32-N6-O2
Molecular weight： 520.636
InChI： InChI=1S/C31H32N6O2/c1-2-9-25(10-3-1)37-21-32-28-29(33-23-13-15-24(16-14-23)36-17-19-38-20-18-36)34-31(35-30(28)37)39-27-12-6-8-22-7-4-5-11-26(22)27/h4-8,11-16,21,25H,1-3,9-10,17-20H2,(H,33,34,35)
InChI key： FYBHCRQFSFYWPY-UHFFFAOYSA-N
SMILES： C1CCC(CC1)n1cnc2c(Nc3ccc(cc3)N3CCOCC3)nc(Oc3cccc4ccccc34)nc12
Systematic name  (3)：
  • N-(4-モルホリノフェニル)-2-(1-ナフチルオキシ)-9-シクロヘキシル-9H-プリン-6-アミン
  • 9-シクロヘキシル-N-[4-(モルホリン-4-イル)フェニル]-2-(ナフタレン-1-イルオキシ)-9H-プリン-6-アミン
  • 9-cyclohexyl-N-[4-(morpholin-4-yl)phenyl]-2-(naphthalen-1-yloxy)-9H-purin-6-amine
Other name (3)：
  • N-(4-Morpholinophenyl)-2-(1-naphthyloxy)-9-cyclohexyl-9H-purine-6-amine
  • プルモルファミン
  • Purmorphamine
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