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CHEBI:139557 - antalarmin

ChEBI IDCHEBI:139557
ChEBI Nameantalarmin
Stars
DefinitionA pyrrolopyrimidine that is 7H-pyrrolo[2,3-d]pyrimidin-4-amine which is substituted by methyl groups at positions 2, 5, and 6, by a mesityl group at position 7, and in which the amino substituent at position 4 has been substituted by ethyl and butyl groups. It is an antagonist of corticotropin-releasing factor 1 (CRF-1) receptors (Ki = 1 nM).
Last Modified14 February 2018
Submitterddomingo
DownloadsMolfile
FormulaC24H34N4
Net Charge0
Average Mass378.564
Monoisotopic Mass378.27835
SMILESCCCCN(CC)c1nc(C)nc2c1c(C)c(C)n2-c1c(C)cc(C)cc1C
InChIInChI=1S/C24H34N4/c1-9-11-12-27(10-2)23-21-18(6)19(7)28(24(21)26-20(8)25-23)22-16(4)13-15(3)14-17(22)5/h13-14H,9-12H2,1-8H3
InChIKeyIXPROWGEHNVJOY-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
corticotropin-releasing factor receptor antagonist  A hormone antagonist that blocks corticotropin-releasing factor receptors
Application:
corticotropin-releasing factor receptor antagonist  A hormone antagonist that blocks corticotropin-releasing factor receptors
ChEBI Ontology
Outgoing Relation(s)
antalarmin (CHEBI:139557) has role corticotropin-releasing factor receptor antagonist (CHEBI:76977)
antalarmin (CHEBI:139557) is a pyrrolopyrimidine (CHEBI:38670)
antalarmin (CHEBI:139557) is a tertiary amino compound (CHEBI:50996)
IUPAC Name 
N-butyl-N-ethyl-7-mesityl-2,5,6-trimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Manual XrefsDatabases
AntalarminWikipedia
Registry NumbersSources
CAS:157284-96-3ChemIDplus
Citations