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(Q83036656)
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English
Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl-, (5alpha,6alpha,14alpha)-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
morphinan alkaloid
1 reference
based on heuristic
inferred from SMILES
mass
285.136493468
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
(5alpha,6beta)-7,8-Didehydro-4,5-epoxy-17-methylmorphinan-3,6-diol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(+)-morphine
1 reference
based on heuristic
inferred from InChI
morphine
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₁₉NO₃
0 references
canonical SMILES
CN1CCC23c4c5ccc(O)c4OC2C(O)C=CC3C1C5
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CN1CC[C@]23[C@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)O
0 references
Identifiers
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/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11-,13+,16+,17+/m1/s1
0 references
InChIKey
BQJCRHHNABKAKU-CNQLIBLSSA-N
0 references
CAS Registry Number
16206-77-2
0 references
PubChem CID
5491823
1 reference
matched by identifier from
InChIKey
InChIKey
BQJCRHHNABKAKU-CNQLIBLSSA-N
UniChem compound ID
60006684
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40167308
1 reference
matched by identifier from
InChIKey
InChIKey
BQJCRHHNABKAKU-CNQLIBLSSA-N
DSSTOX compound identifier
DTXCID8089799
0 references
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