Statements (20)
| Predicate | Object |
|---|---|
| gptkbp:instanceOf |
gptkb:chemical_compound
|
| gptkbp:hasBiologicalActivity |
norepinephrine reuptake inhibitor
mu-opioid receptor agonist |
| gptkbp:hasEnantiomer |
(1S,2S)-2-[(dimethylamino)methyl]-1-(3-hydroxyphenyl)cyclohexanol
|
| gptkbp:hasInChIKey |
QZVZEKZQGJFQDC-LLVKDONJSA-N
|
| gptkbp:hasMolecularFormula |
C17H19NO3
|
| gptkbp:hasRole |
analgesic
opioid metabolite |
| gptkbp:hasSMILES |
CN(C)CC1(CCCCC1O)C2=CC=CC=C2O
|
| gptkbp:hasStandardInChI |
InChI=1S/C16H25NO2/c1-17(2)11-15(12-5-3-4-6-14(12)18)13-7-9-16(19)10-8-13/h3-6,13,15-16,18-19H,7-11H2,1-2H3/t13-,15-,16-/m0/s1
|
| https://www.w3.org/2000/01/rdf-schema#label |
CHEMBL1201313
|
| gptkbp:IUPACName |
(1R,2R)-2-[(dimethylamino)methyl]-1-(3-hydroxyphenyl)cyclohexanol
|
| gptkbp:metabolism |
gptkb:tramadol
|
| gptkbp:molecularWeight |
285.34
|
| gptkbp:parent |
gptkb:tramadol
|
| gptkbp:PubChem_CID |
gptkb:CHEMBL1201313
|
| gptkbp:synonym |
N-Desmethyltramadol
O-Desmethyltramadol |
| gptkbp:bfsParent |
gptkb:formoterol
|
| gptkbp:bfsLayer |
6
|