CHEBI:73284 - N-ethyl-5'-carboxamidoadenosine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-ethyl-5'-carboxamidoadenosine
ChEBI ASCII Name N-ethyl-5'-carboxamidoadenosine
Definition A derivative of adenosine in which the 5'-hydroxymethyl group is replaced by an N-ethylcarboxamido group.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Margaret Duesbury
Secondary ChEBI IDs CHEBI:44344
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C12H16N6O4
Net Charge 0
Average Mass 308.29320
Monoisotopic Mass 308.12330
InChI InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1
SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Roles Classification
Biological Role(s): adenosine A1 receptor agonist
An agonist at the A1 receptor.
adenosine A2A receptor agonist
An agonist at the A2A receptor.
EC 3.1.4.* (phosphoric diester hydrolase) inhibitor
An EC 3.1.* (ester hydrolase) inhibitor that interferes with the action of a phosphoric diester hydrolase (EC 3.1.4.*).
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
vasodilator agent
A drug used to cause dilation of the blood vessels.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing N-ethyl-5'-carboxamidoadenosine (CHEBI:73284) has functional parent adenosine (CHEBI:16335)
N-ethyl-5'-carboxamidoadenosine (CHEBI:73284) has role adenosine A1 receptor agonist (CHEBI:65057)
N-ethyl-5'-carboxamidoadenosine (CHEBI:73284) has role adenosine A2A receptor agonist (CHEBI:73310)
N-ethyl-5'-carboxamidoadenosine (CHEBI:73284) has role antineoplastic agent (CHEBI:35610)
N-ethyl-5'-carboxamidoadenosine (CHEBI:73284) has role EC 3.1.4.* (phosphoric diester hydrolase) inhibitor (CHEBI:50218)
N-ethyl-5'-carboxamidoadenosine (CHEBI:73284) has role vasodilator agent (CHEBI:35620)
N-ethyl-5'-carboxamidoadenosine (CHEBI:73284) is a adenosines (CHEBI:22260)
N-ethyl-5'-carboxamidoadenosine (CHEBI:73284) is a monocarboxylic acid amide (CHEBI:29347)
Synonyms Sources
1-(6-Amino-9H-purin-9-yl)-1-deoxy-N-ethyl-beta-D-ribofuranuronamide ChemIDplus
5'-N-Ethylcarboxamidoadenosine ChemIDplus
Adenosine-5'-(N-ethylcarboxamide) ChemIDplus
NECA ChemIDplus
Manual Xrefs Databases
DB03719 DrugBank
US2007281902 Patent
WO2009006089 Patent
View more database links
Registry Numbers Types Sources
35920-39-9 CAS Registry Number ChemIDplus
630061 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
23215695 PubMed citation Europe PMC
23396225 PubMed citation Europe PMC
23429888 PubMed citation Europe PMC
23453966 PubMed citation Europe PMC
23597562 PubMed citation Europe PMC
Last Modified
05 March 2014