Nubain

Nalbuphine A narcotic used as a pain medication. It appears to be an agonist at kappa opioid receptors and an antagonist or partial agonist at mu opioid receptors.

Molecular Formula: C₂₁H₂₈ClNO₄

InChI: InChI=1/C21H27NO4.ClH/c23-14-5-4-13-10-16-21(25)7-6-15(24)19-20(21,17(13)18(14)26-19)8-9-22(16)11-12-2-1-3-12;/h4-5,12,15-16,19,23-25H,1-3,6-11H2;1H/t15-,16+,19-,20-,21+;/m0./s1

InChIKey: InChIKey=YZLZPSJXMWGIFH-BCXQGASEBY
SMILES: C1CC(C1)CN2CCC34C5C(CCC3(C2CC6=C4C(=C(C=C6)O)O5)O)O.Cl

Names:
    EINECS 245-549-9
    En 2234A
    Nalbufina clorhidrato [Spanish]
    Nalbuphine hydrochloride [USAN]
    NALBUPHINE HYDROCHLORIDE
    Nubain
    N-Cyclobutylmethyl-14-hydroxydihydronormorphine hydrochloride
    (5alpha,6alpha)-17-(Cyclobutylmethyl)-4,5-epoxymorphinan-3,6,14-triol hydrochloride
    17-(Cyclobutylmethyl)-4,5alpha-epoxymorphinan-3,6alpha,14-triol hydrochloride
    23277-43-2

Registries:
    PubChem CID 5360733
    PubChem ID 173848