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CHEBI:4912 - etorphine

Default Structure
ChEBI IDCHEBI:4912
ChEBI Nameetorphine
Stars
Last Modified6 October 2020
DownloadsMolfile
FormulaC25H33NO4
Net Charge0
Average Mass411.542
Monoisotopic Mass411.24096
SMILES[H][C@]1([C@](C)(O)CCC)C[C@@]23C=C[C@]1(OC)[C@@H]1Oc4c(O)ccc5c4[C@@]12CCN(C)[C@@H]3C5
InChIInChI=1S/C25H33NO4/c1-5-8-22(2,28)17-14-23-9-10-25(17,29-4)21-24(23)11-12-26(3)18(23)13-15-6-7-16(27)20(30-21)19(15)24/h6-7,9-10,17-18,21,27-28H,5,8,11-14H2,1-4H3/t17-,18-,21-,22-,23-,24+,25-/m1/s1
InChIKeyCAHCBJPUTCKATP-FAWZKKEFSA-N
Wikipedia
Roles Classification
Biological Roles:
opioid receptor agonist  An agent that selectively binds to and activates an 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.
Applications:
sedative  A central nervous system depressant used to induce drowsiness or sleep or to reduce psychological excitement or anxiety.
opioid receptor agonist  An agent that selectively binds to and activates an opioid receptor.
opioid analgesic  A narcotic or opioid substance, synthetic or semisynthetic agent producing profound analgesia, drowsiness, and changes in mood.
ChEBI Ontology
Outgoing Relation(s)
etorphine (CHEBI:4912) has role opioid analgesic (CHEBI:35482)
etorphine (CHEBI:4912) has role opioid receptor agonist (CHEBI:60606)
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 
(7R)-7-[(2R)-2-hydroxypentan-2-yl]-6-methoxy-17-methyl-5α-4,5-epoxy-6,14-ethenomorphinan-3-ol
INNs  Source
etorfinaWHO MedNet
etorphineWHO MedNet
étorphineWHO MedNet
etorphinumWHO MedNet
Synonyms  Source
19-PropylorvinolChemIDplus
7,8-Dihydro-7-alpha-(1-(R)-hydroxy-1-methylbutyl)-O(sup 6)-methyl-6,14-endo-ethenomorphineChemIDplus
7-alpha-(1-(R)-Hydroxy-1-methylbutyl)-6,14-endo-ethenotetrahydrooripavineChemIDplus
7α-EtorphineChemIDplus
(−)-etorphineChemIDplus
Tetrahydro-7-alpha-(2-hydroxy-2-pentyl)-6,14-endo-ethenooripavineChemIDplus
Manual XrefsDatabases
BE618392Patent
C11793KEGG COMPOUND
D07937KEGG DRUG
DB01497DrugBank
EtorphineWikipedia
GB937214Patent
US3763167Patent
Registry NumbersSources
Beilstein:4920991Beilstein
CAS:14521-96-1ChemIDplus
CAS:14521-96-1NIST Chemistry WebBook
Citations