Chem
J-GLOBAL ID:200907000418823534   Nikkaji number:J1.329.874B

(αR)-α-Ethoxy-4,5α-epoxy-3,6-dimethoxy-α,17-dimethyl-6,14-ethenomorphinan-7α-methanol

(αR)-α-エトキシ-4,5α-エポキシ-3,6-ジメトキシ-α,17-ジメチル-6,14-エテノモルフィナン-7α-メタノール
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: C25H33NO5
Molecular formula furigana: C25-H33-N-O5
Molecular weight: 427.541
InChI: InChI=1S/C25H33NO5/c1-6-30-22(2,27)17-14-23-9-10-25(17,29-5)21-24(23)11-12-26(3)18(23)13-15-7-8-16(28-4)20(31-21)19(15)24/h7-10,17-18,21,27H,6,11-14H2,1-5H3/t17-,18-,21-,22-,23+,24+,25?/m1/s1
InChI key: MGAJMPVBROEPDQ-RXTQVUKOSA-N
SMILES: CCO[C@@](C)(O)[C@H]1C[C@@]23C=CC1(OC)[C@@H]1Oc4c5c(C[C@H]2N(C)CC[C@@]315)ccc4OC
Systematic name  (3):
  • (αR)-α-エトキシ-4,5α-エポキシ-3,6-ジメトキシ-α,17-ジメチル-6,14-エテノモルフィナン-7α-メタノール
  • (1R)-1-[(1S,2R,6S,14R,16S)-11,15-ジメトキシ-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),8,10,18-テトラエン-16-イル]-1-エトキシエタン-1-オール
  • (1R)-1-[(1S,2R,6S,14R,16S)-11,15-dimethoxy-3-methyl-13-oxa-3-azahexacyclo[13.2.2.12,8.01,6.06,14.07,12]icosa-7(12),8,10,18-tetraen-16-yl]-1-ethoxyethan-1-ol
Other name (1):
  • (αR)-α-Ethoxy-4,5α-epoxy-3,6-dimethoxy-α,17-dimethyl-6,14-ethenomorphinan-7α-methanol
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