CHEBI:4912 - etorphine

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ChEBI Name etorphine
ChEBI ID CHEBI:4912
Stars This entity has been manually annotated by the ChEBI Team.
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Formulae C25H33NO3
C25H33NO4
Net Charge 0
Average Mass 395.53440
Monoisotopic Mass 411.241
InChI InChI=1S/C25H33NO3/c1-5-9-22(2,27)18-15-23-10-11-25(18,28-4)21-24(23)12-13-26(3)19(23)14-16-7-6-8-17(29-21)20(16)24/h6-8,10-11,18-19,21,27H,5,9,12-15H2,1-4H3/t18-,19-,21-,22-,23-,24+,25-/m1/s1
InChIKey QRHQPCRIZNMZIZ-MASJHSKDSA-N
SMILES CCC[C@@](C)(O)[C@H]1C[C@]23C=C[C@]1(OC)[C@@H]1Oc4cccc5C[C@H]2N(C)CC[C@@]31c45
Roles Classification
Biological Role(s): 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): opioid analgesic
A narcotic or opioid substance, synthetic or semisynthetic agent producing profound analgesia, drowsiness, and changes in mood.
sedative
A central nervous system depressant used to induce drowsiness or sleep or to reduce psychological excitement or anxiety.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing etorphine (CHEBI:4912) has role opioid analgesic (CHEBI:35482)
etorphine (CHEBI:4912) has role sedative (CHEBI:35717)
etorphine (CHEBI:4912) is a alcohol (CHEBI:30879)
etorphine (CHEBI:4912) is a morphinane alkaloid (CHEBI:25418)
IUPAC Name
2R-[(4R,4aR,7R,7aR,12bS,14R)-7-methoxy-3-methyl-1,2,3,4,7,7a-hexahydro-4a,7-ethano-4,12-methano[1]benzofuro[3,2-e]isoquinolin-14-yl]pentan-2-ol
INNs Sources
etorfina ChEBI
étorphine ChEBI
etorphine ChemIDplus
etorphinum ChEBI
Synonyms Sources
19-Propylorvinol ChemIDplus
7,8-Dihydro-7-alpha-(1-(R)-hydroxy-1-methylbutyl)-O(sup 6)-methyl-6,14-endo-ethenomorphine ChemIDplus
7-alpha-(1-(R)-Hydroxy-1-methylbutyl)-6,14-endo-ethenotetrahydrooripavine ChemIDplus
7α-Etorphine ChemIDplus
Tetrahydro-7-alpha-(2-hydroxy-2-pentyl)-6,14-endo-ethenooripavine ChemIDplus
Manual Xrefs Databases
BE618392 Patent
C11793 KEGG COMPOUND
DB01497 DrugBank
Etorphine Wikipedia
GB937214 Patent
US3763167 Patent
View more database links
Registry Numbers Types Sources
14521-96-1 CAS Registry Number ChemIDplus
4920991 Beilstein Registry Number Beilstein
Last Modified
30 January 2015