Chem
J-GLOBAL ID：200907057029300277   Nikkaji number：J934.495K

N-Methyl-N-[3,14-dihydroxy-17-(cyclopropylmethyl)-4,5α-epoxymorphinan-6β-yl]benzenepropionamide

N-メチル-N-[3,14-ジヒドロキシ-17-(シクロプロピルメチル)-4,5α-エポキシモルフィナン-6β-イル]ベンゼンプロピオンアミド
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： C30H36N2O4
Molecular formula furigana： C30-H36-N2-O4
Molecular weight： 488.628
InChI： InChI=1S/C30H36N2O4/c1-31(25(34)12-9-19-5-3-2-4-6-19)22-13-14-30(35)24-17-21-10-11-23(33)27-26(21)29(30,28(22)36-27)15-16-32(24)18-20-7-8-20/h2-6,10-11,20,22,24,28,33,35H,7-9,12-18H2,1H3/t22-,24-,28+,29+,30-/m1/s1
InChI key： LTOZCOBTYYLIEQ-ALJHJIAZSA-N
SMILES： CN([C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3CC1CC1)c45)C(=O)CCc1ccccc1
Systematic name  (3)：
  • N-メチル-N-[3,14-ジヒドロキシ-17-(シクロプロピルメチル)-4,5α-エポキシモルフィナン-6β-イル]ベンゼンプロピオンアミド
  • N-[(1S,5R,13R,14R,17S)-4-(シクロプロピルメチル)-10,17-ジヒドロキシ-12-オキサ-4-アザペンタシクロ[9.6.1.01,13.05,17.07,18]オクタデカ-7,9,11(18)-トリエン-14-イル]-N-メチル-3-フェニルプロパンアミド
  • N-[(1S,5R,13R,14R,17S)-4-(cyclopropylmethyl)-10,17-dihydroxy-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7,9,11(18)-trien-14-yl]-N-methyl-3-phenylpropanamide
Other name (1)：
  • N-Methyl-N-[3,14-dihydroxy-17-(cyclopropylmethyl)-4,5α-epoxymorphinan-6β-yl]benzenepropionamide
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