CHEBI:156213 - (4-{[(3,5-dimethylisoxazol-4-yl)methyl]amino}quinazolin-2-yl)methanol

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ChEBI Name (4-{[(3,5-dimethylisoxazol-4-yl)methyl]amino}quinazolin-2-yl)methanol
ChEBI ID CHEBI:156213
Definition A quinazoline carrying a hydroxymethyl substituent at C-2 and a [(3,5-dimethyl-1,2-oxazol-4-yl)methyl]amino group at C-4. One of a series of mucosal-associated invariant T (MAIT) cell agonists.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C15H16N4O2
Net Charge 0
Average Mass 284.319
Monoisotopic Mass 284.12733
InChI InChI=1S/C15H16N4O2/c1-9-12(10(2)21-19-9)7-16-15-11-5-3-4-6-13(11)17-14(8-20)18-15/h3-6,20H,7-8H2,1-2H3,(H,16,17,18)
InChIKey FRMINCOCTGQAJC-UHFFFAOYSA-N
SMILES C12=CC=CC=C2N=C(N=C1NCC3=C(ON=C3C)C)CO
Roles Classification
Biological Role(s): MAIT cell agonist
An agonist that selectively binds to and activates mucosal associated invariant T cells (MAIT cells).
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ChEBI Ontology
Outgoing (4-{[(3,5-dimethylisoxazol-4-yl)methyl]amino}quinazolin-2-yl)methanol (CHEBI:156213) has role MAIT cell agonist (CHEBI:156211)
(4-{[(3,5-dimethylisoxazol-4-yl)methyl]amino}quinazolin-2-yl)methanol (CHEBI:156213) is a quinazolines (CHEBI:38530)
IUPAC Name
(4-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]amino}quinazolin-2-yl)methanol
Synonyms Sources
(4-(((3,5-dimethylisoxazol-4-yl)methyl)amino)quinazolin-2-yl)methanol ChEBI
DB-12 ChEBI
DB12 ChEBI
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32341160 PubMed citation Europe PMC
Last Modified
17 July 2020