Chem
J-GLOBAL ID:200907017868122730
Nikkaji number:J11.325E
Codeinone
コデイノン
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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:
C18 H19 NO3
Molecular formula furigana:
C18-H19-N-O3
Molecular weight:
297.354
InChI:
InChI=1S/C18H19NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-12,17H,7-9H2,1-2H3/t11-,12+,17-,18-/m0/s1
InChI key:
XYYVYLMBEZUESM-CMKMFDCUSA-N
SMILES:
COc1ccc2C[C@@H]3[C@@H]4C=CC(=O)[C@@H]5Oc1c2[C@]45CCN3C
Systematic name (5):
7,8-ジデヒドロ-4,5α-エポキシ-3-メトキシ-17-メチルモルフィナン-6-オン
(5R)-3-メトキシ-7,8-ジデヒドロ-4,5-エポキシ-17-メチルモルフィナン-6-オン
3-メトキシ-17-メチル-4,5α-エポキシ-7,8-ジデヒドロモルフィナン-6-オン
(1S,5R,13R,17R)-10-メトキシ-4-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),15-テトラエン-14-オン
(1S,5R,13R,17R)-10-methoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.01,13 .05,17 .07,18 ]octadeca-7,9,11(18),15-tetraen-14-one
Other name (7):
コデイノン
Codeinone
7,8-Didehydro-4,5α-epoxy-3-methoxy-17-methylmorphinan-6-one
6-オキソコデイン
6-Oxocodeine
(5R)-3-Methoxy-7,8-didehydro-4,5-epoxy-17-methylmorphinan-6-one
3-Methoxy-17-methyl-4,5α-epoxy-7,8-didehydromorphinan-6-one
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CAS registry number:
467-13-0
Regulation number (2):
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