Chem
J-GLOBAL ID：200907001108723188   Nikkaji number：J1.933.958K

3-Methoxy-5,17-dimethyl-14β-[(2E,4E)-5-phenyl-2,4-pentadienyl]-7,8-didehydro-4,5α-epoxymorphinan-6-one

3-メトキシ-5,17-ジメチル-14β-[(2E,4E)-5-フェニル-2,4-ペンタジエニル]-7,8-ジデヒドロ-4,5α-エポキシモルフィナン-6-オン
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： C30H31NO3
Molecular formula furigana： C30-H31-N-O3
Molecular weight： 453.582
InChI： InChI=1S/C30H31NO3/c1-28-25(32)15-17-29(16-9-5-8-12-21-10-6-4-7-11-21)24-20-22-13-14-23(33-3)27(34-28)26(22)30(28,29)18-19-31(24)2/h4-15,17,24H,16,18-20H2,1-3H3/b9-5+,12-8+/t24-,28+,29+,30+/m1/s1
InChI key： SDSVMFVYNGKCAH-XJMDGJOGSA-N
SMILES： COc1ccc2C[C@H]3N(C)CC[C@]45c2c1O[C@@]4(C)C(=O)C=C[C@@]35C/C=C/C=C/c1ccccc1
Systematic name  (3)：
  • 3-メトキシ-5,17-ジメチル-14β-[(2E,4E)-5-フェニル-2,4-ペンタジエニル]-7,8-ジデヒドロ-4,5α-エポキシモルフィナン-6-オン
  • (1S,5R,13R,17R)-10-メトキシ-4,13-ジメチル-17-[(2E,4E)-5-フェニルペンタ-2,4-ジエン-1-イル]-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),15-テトラエン-14-オン
  • (1S,5R,13R,17R)-10-methoxy-4,13-dimethyl-17-[(2E,4E)-5-phenylpenta-2,4-dien-1-yl]-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7,9,11(18),15-tetraen-14-one
Other name (1)：
  • 3-Methoxy-5,17-dimethyl-14β-[(2E,4E)-5-phenyl-2,4-pentadienyl]-7,8-didehydro-4,5α-epoxymorphinan-6-one
Thsaurus map：
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