CHEBI:73357 - U69593

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ChEBI Name U69593
Definition A monocarboxylic acid amide obtained by formal condensation between the carboxy group of phenylacetic acid and the secodary amino group of (5R,7S,8S)-N-methyl-7-(pyrrolidin-1-yl)-1-oxaspiro[4.5]decan-8-amine.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Margaret Duesbury
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Formula C22H32N2O2
Net Charge 0
Average Mass 356.50170
Monoisotopic Mass 356.24638
InChI InChI=1S/C22H32N2O2/c1-23(21(25)16-18-8-3-2-4-9-18)19-10-12-22(11-7-15-26-22)17-20(19)24-13-5-6-14-24/h2-4,8-9,19-20H,5-7,10-17H2,1H3/t19-,20-,22-/m0/s1
SMILES CN([C@H]1CC[C@@]2(CCCO2)C[C@@H]1N1CCCC1)C(=O)Cc1ccccc1
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): kappa-opioid receptor agonist
A compound that exhibits agonist activity at the kappa-opioid receptor.
Application(s): kappa-opioid receptor agonist
A compound that exhibits agonist activity at the kappa-opioid receptor.
anti-inflammatory agent
Any compound that has anti-inflammatory effects.
An agent that promotes the excretion of urine through its effects on kidney function.
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ChEBI Ontology
Outgoing U69593 (CHEBI:73357) has role κ-opioid receptor agonist (CHEBI:59282)
U69593 (CHEBI:73357) has role anti-inflammatory agent (CHEBI:67079)
U69593 (CHEBI:73357) has role diuretic (CHEBI:35498)
U69593 (CHEBI:73357) is a N-alkylpyrrolidine (CHEBI:46775)
U69593 (CHEBI:73357) is a monocarboxylic acid amide (CHEBI:29347)
U69593 (CHEBI:73357) is a organic heterobicyclic compound (CHEBI:27171)
U69593 (CHEBI:73357) is a oxaspiro compound (CHEBI:37948)
Synonyms Sources
(5α,7α,8β)-(−)-N-methyl-N-(7-(1-pyrrolidinyl)-1-oxaspiro(4.5)dec-8-yl)-benzeneacetamide ChemIDplus
N-methyl-N-((5R,7S,8S)-7-(1-pyrrolidinyl)-1-oxaspiro(4.5)dec-8-yl)-benzeneacetamide ChemIDplus
U 69,593 ChemIDplus
U 69593 ChemIDplus
U-69593 ChemIDplus
Manual Xref Database
U-69,593 Wikipedia
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Registry Numbers Types Sources
7488908 Reaxys Registry Number Reaxys
96744-75-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
18929596 PubMed citation Europe PMC
19747933 PubMed citation Europe PMC
20939060 PubMed citation Europe PMC
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22816017 PubMed citation Europe PMC
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Last Modified
06 March 2014