Statements (15)
| Predicate | Object |
|---|---|
| gptkbp:instanceOf |
gptkb:chemical_compound
|
| gptkbp:CASNumber |
76-57-3
|
| gptkbp:hasInChIKey |
gptkb:WQZGKKKJIJFFOK-GASJEMHNSA-N
|
| gptkbp:hasMolecularFormula |
C17H19NO3
|
| gptkbp:hasSMILES |
COc1ccc2c3c1O[C@H]1C[C@@H](N(C)CC1)[C@H]3CC2
|
| gptkbp:hasUNII |
Y8335394RO
|
| https://www.w3.org/2000/01/rdf-schema#label |
WQZGKKKJIJFFOK-GASJEMHNSA-N
|
| gptkbp:isomerOf |
gptkb:codeine
gptkb:morphine |
| gptkbp:IUPACName |
(5α,6α)-7,8-didehydro-4,5-epoxy-3-methoxy-17-methylmorphinan-6-ol
|
| gptkbp:PubChem_CID |
CHEMBL1201207
5288826 4455382 |
| gptkbp:bfsParent |
gptkb:CHEBI:16716
|
| gptkbp:bfsLayer |
7
|