Chem
J-GLOBAL ID:200907049364416309   Nikkaji number:J1.719.194B

6,7-(3-Methyl-1,4-diphenyl-2-aza-3-butene-2,4-diyl)-4,5α-epoxy-17-(cyclopropylmethyl)-6,7-didehydromorphinan-3,14-diol

6,7-(3-メチル-1,4-ジフェニル-2-アザ-3-ブテン-2,4-ジイル)-4,5α-エポキシ-17-(シクロプロピルメチル)-6,7-ジデヒドロモルフィナン-3,14-ジオール
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: C36H36N2O3
Molecular formula furigana: C36-H36-N2-O3
Molecular weight: 544.695
InChI: InChI=1S/C36H36N2O3/c1-22-30(25-10-6-3-7-11-25)27-19-36(40)29-18-26-14-15-28(39)33-31(26)35(36,16-17-37(29)20-24-12-13-24)34(41-33)32(27)38(22)21-23-8-4-2-5-9-23/h2-11,14-15,24,29,34,39-40H,12-13,16-21H2,1H3/t29-,34+,35+,36-/m1/s1
InChI key: XKUPUVJJRUFEFD-FHPDIGCUSA-N
SMILES: Cc1c(c2C[C@@]3(O)[C@H]4Cc5ccc(O)c6O[C@@H](c2n1Cc1ccccc1)[C@]3(CCN4CC1CC1)c56)c1ccccc1
Systematic name  (3):
  • 6,7-(3-メチル-1,4-ジフェニル-2-アザ-3-ブテン-2,4-ジイル)-4,5α-エポキシ-17-(シクロプロピルメチル)-6,7-ジデヒドロモルフィナン-3,14-ジオール
  • (1S,2S,9R,17R)-7-ベンジル-18-(シクロプロピルメチル)-6-メチル-5-フェニル-10-オキサ-7,18-ジアザヘキサシクロ[9.9.1.01,9.02,17.04,8.015,21]ヘンイコサ-4(8),5,11(21),12,14-ペンタエン-2,12-ジオール
  • (1S,2S,9R,17R)-7-benzyl-18-(cyclopropylmethyl)-6-methyl-5-phenyl-10-oxa-7,18-diazahexacyclo[9.9.1.01,9.02,17.04,8.015,21]henicosa-4(8),5,11(21),12,14-pentaene-2,12-diol
Other name (1):
  • 6,7-(3-Methyl-1,4-diphenyl-2-aza-3-butene-2,4-diyl)-4,5α-epoxy-17-(cyclopropylmethyl)-6,7-didehydromorphinan-3,14-diol
Thsaurus map:

Return to Previous Page