CHEBI:3243 - butorphanol D-tartrate

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ChEBI Name butorphanol D-tartrate
ChEBI ID CHEBI:3243
ChEBI ASCII Name butorphanol D-tartrate
Definition The (S,S)-tartaric acid salt of butorphanol. It is used for relief or moderate to severe pain.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:176963
Supplier Information
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Formula C25H35NO8
Net Charge 0
Average Mass 477.54730
Monoisotopic Mass 477.23627
InChI InChI=1S/C21H29NO2.C4H6O6/c23-17-7-6-16-12-19-21(24)9-2-1-8-20(21,18(16)13-17)10-11-22(19)14-15-4-3-5-15;5-1(3(7)8)2(6)4(9)10/h6-7,13,15,19,23-24H,1-5,8-12,14H2;1-2,5-6H,(H,7,8)(H,9,10)/t19-,20+,21-;1-,2-/m10/s1
InChIKey GMTYREVWZXJPLF-AFHUBHILSA-N
SMILES O[C@@H]([C@H](O)C(O)=O)C(O)=O.Oc1ccc2C[C@H]3N(CC[C@@]4(CCCC[C@@]34O)c2c1)CC1CCC1
Roles Classification
Biological Role(s): kappa-opioid receptor agonist
A compound that exhibits agonist activity at the kappa-opioid receptor.
mu-opioid receptor agonist
A compound that exhibits agonist activity at the mu-opioid receptor.
opioid analgesic
A narcotic or opioid substance, synthetic or semisynthetic agent producing profound analgesia, drowsiness, and changes in mood.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
Application(s): kappa-opioid receptor agonist
A compound that exhibits agonist activity at the kappa-opioid receptor.
mu-opioid receptor agonist
A compound that exhibits agonist activity at the mu-opioid receptor.
opioid analgesic
A narcotic or opioid substance, synthetic or semisynthetic agent producing profound analgesia, drowsiness, and changes in mood.
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ChEBI Ontology
Outgoing butorphanol D-tartrate (CHEBI:3243) has part butorphanol (CHEBI:3242)
butorphanol D-tartrate (CHEBI:3243) has role κ-opioid receptor agonist (CHEBI:59282)
butorphanol D-tartrate (CHEBI:3243) has role μ-opioid receptor agonist (CHEBI:55322)
butorphanol D-tartrate (CHEBI:3243) has role opioid analgesic (CHEBI:35482)
butorphanol D-tartrate (CHEBI:3243) is a morphinane alkaloid (CHEBI:25418)
butorphanol D-tartrate (CHEBI:3243) is a tartrate salt (CHEBI:50562)
IUPAC Name
17-(cyclobutylmethyl)morphinan-3,14-diol (2S,3S)-2,3-dihydroxybutanedioate
Synonyms Sources
(−)-17-(cyclobutylmethyl)morphinan-3,14-diol D-(−)-tartrate ChemIDplus
(−)-N-cyclobutylmethyl-3,14-dihydroxymorphinan D-(−)-tartrate ChEBI
17-(cyclobutylmethyl)morphinan-3,14-diyl [S-(R*,R*)]-2,3-dihydroxysuccinate ChemIDplus
butorphanol (−)-tartrate ChEBI
butorphanol (S,S)-tartrate ChEBI
butorphanol D-tartrate ChEBI
Manual Xrefs Databases
D00837 KEGG DRUG
DB00611 DrugBank
View more database links
Registry Numbers Types Sources
5234837 Beilstein Registry Number Beilstein
58786-99-5 CAS Registry Number ChemIDplus
58786-99-5 CAS Registry Number KEGG DRUG
Last Modified
26 April 2010