Chem
J-GLOBAL ID：200907049426596562
Nikkaji number：J1.708.215I
(5R)-3-Hydroxy-17-(2H3)methyl-4,5-epoxymorphinan-6-one
(5R)-3-ヒドロキシ-17-(2H3)メチル-4,5-エポキシモルフィナン-6-オン
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
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
Molecular formula： C17H16[2H]3NO3
Molecular formula furigana： C17-H19-N-O3
Molecular weight： 288.361
InChI：
InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2,4,10-11,16,19H,3,5-8H2,1H3/t10-,11+,16-,17-/m0/s1/i1D3
InChI key：
WVLOADHCBXTIJK-HOSVTXOBSA-N
SMILES：
C([2H])([2H])([2H])N1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3CCC4=O)ccc5O
Systematic name (3)：
- (5R)-3-ヒドロキシ-17-(2H3)メチル-4,5-エポキシモルフィナン-6-オン
- (1S,5R,13R,17R)-10-ヒドロキシ-4-(2H3)メチル-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)-トリエン-14-オン
- (1S,5R,13R,17R)-10-hydroxy-4-(2H3)methyl-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7,9,11(18)-trien-14-one
- (5R)-3-Hydroxy-17-(2H3)methyl-4,5-epoxymorphinan-6-one
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