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CHEBI:35940 - protirelin

Default Structure
ChEBI IDCHEBI:35940
ChEBI Nameprotirelin
Stars
DefinitionA tripeptide composed of L-pyroglutamyl, L-histidyl and L-prolinamide residues joined in sequence.
Secondary ChEBI IDsCHEBI:8584, CHEBI:9585
Last Modified22 February 2017
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC16H22N6O4
Net Charge0
Average Mass362.390
Monoisotopic Mass362.17025
SMILESNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cncn1)NC(=O)[C@@H]1CCC(=O)N1
InChIInChI=1S/C16H22N6O4/c17-14(24)12-2-1-5-22(12)16(26)11(6-9-7-18-8-19-9)21-15(25)10-3-4-13(23)20-10/h7-8,10-12H,1-6H2,(H2,17,24)(H,18,19)(H,20,23)(H,21,25)/t10-,11-,12-/m0/s1
InChIKeyXNSAINXGIQZQOO-SRVKXCTJSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
hormone  Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
protirelin (CHEBI:35940) has role antineoplastic agent (CHEBI:35610)
protirelin (CHEBI:35940) has role human metabolite (CHEBI:77746)
protirelin (CHEBI:35940) is a peptide hormone (CHEBI:25905)
protirelin (CHEBI:35940) is a tripeptide (CHEBI:47923)
IUPAC Name 
5-oxo-L-prolyl-L-histidyl-L-prolinamide
INNs  Source
protirelinaWHO MedNet
protirelineWHO MedNet
Synonyms  Source
5-oxo-pro-his-pro-nh2ChEMBL
A-38579ChEMBL
ABBOTT-38579ChEMBL
L-Pyroglutamyl-L-histidyl-L-prolineamideChemIDplus
NSC-760113ChEMBL
ProtirelinKEGG COMPOUND
Brand Names  Source
ThypinoneChEMBL
Thyrel trhChEMBL
Trh-cambridgeChEMBL
Manual XrefsDatabases
2316DrugCentral
C03958KEGG COMPOUND
D00176KEGG DRUG
HMDB0005763HMDB
ProtirelinWikipedia
Registry NumbersSources
Reaxys:903432Reaxys
CAS:24305-27-9KEGG COMPOUND
CAS:24305-27-9ChemIDplus
Citations