Chem
J-GLOBAL ID：200907039605240988   Nikkaji number：J637.473E

(5R,6R,7S,14S)-7-(1-Hydroxy-1-methylethyl)-4,5-epoxy-18,19-dihydro-3-hydroxy-6-methoxy-17-methyl-6,14-ethenomorphinan

(5R,6R,7S,14S)-7-(1-ヒドロキシ-1-メチルエチル)-4,5-エポキシ-18,19-ジヒドロ-3-ヒドロキシ-6-メトキシ-17-メチル-6,14-エテノモルフィナン
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： C23H31NO4
Molecular formula furigana： C23-H31-N-O4
Molecular weight： 385.504
InChI： InChI=1S/C23H31NO4/c1-20(2,26)15-12-21-7-8-23(15,27-4)19-22(21)9-10-24(3)16(21)11-13-5-6-14(25)18(28-19)17(13)22/h5-6,15-16,19,25-26H,7-12H2,1-4H3/t15-,16+,19+,21+,22-,23+/m0/s1
InChI key： URIIOJFHFRUBEG-LRUUPZQASA-N
SMILES： CO[C@]12CC[C@@]3(C[C@H]1C(C)(C)O)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Systematic name  (3)：
  • (5R,6R,7S,14S)-7-(1-ヒドロキシ-1-メチルエチル)-4,5-エポキシ-18,19-ジヒドロ-3-ヒドロキシ-6-メトキシ-17-メチル-6,14-エテノモルフィナン
  • (1S,2R,6S,14R,15R,16S)-16-(2-ヒドロキシプロパン-2-イル)-15-メトキシ-3-メチル-13-オキサ-3-アザヘキサシクロ[13.2.2.12,8.01,6.06,14.07,12]イコサ-7(12),8,10-トリエン-11-オール
  • (1S,2R,6S,14R,15R,16S)-16-(2-hydroxypropan-2-yl)-15-methoxy-3-methyl-13-oxa-3-azahexacyclo[13.2.2.12,8.01,6.06,14.07,12]icosa-7(12),8,10-trien-11-ol
Other name (1)：
  • (5R,6R,7S,14S)-7-(1-Hydroxy-1-methylethyl)-4,5-epoxy-18,19-dihydro-3-hydroxy-6-methoxy-17-methyl-6,14-ethenomorphinan
Thsaurus map：
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