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CHEBI:156218 - (R)-7-{[4-(6-oxo-1,6-dihydropyrimidin-4-yl)piperidin-1-yl]carbonyl}-1,3-diazepane-2,4-dione

ChEBI IDCHEBI:156218
ChEBI Name(R)-7-{[4-(6-oxo-1,6-dihydropyrimidin-4-yl)piperidin-1-yl]carbonyl}-1,3-diazepane-2,4-dione
Stars
ASCII Name(R)-7-{[4-(6-oxo-1,6-dihydropyrimidin-4-yl)piperidin-1-yl]carbonyl}-1,3-diazepane-2,4-dione
DefinitionPiperidine carrying a 6-oxo-1,6-dihydropyrimidin-4-yl group at C-4 and a [(4R)-2,7-dioxo-1,3-diazepan-4-yl]carbonyl substituent on N-1. One of a series of mucosal-associated invariant T (MAIT) cell agonists.
Last Modified20 July 2020
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC15H19N5O4
Net Charge0
Average Mass333.348
Monoisotopic Mass333.14370
SMILESO=C1CC[C@H](C(=O)N2CCC(c3cc(=O)ncn3)CC2)NC(=O)N1
InChIInChI=1S/C15H19N5O4/c21-12-2-1-10(18-15(24)19-12)14(23)20-5-3-9(4-6-20)11-7-13(22)17-8-16-11/h7-10H,1-6H2,(H,16,17,22)(H2,18,19,21,24)/t10-/m1/s1
InChIKeyVMYXFPJOSQLXHG-SNVBAGLBSA-N
ChEBI Ontology
Outgoing Relation(s)
(R)-7-{[4-(6-oxo-1,6-dihydropyrimidin-4-yl)piperidin-1-yl]carbonyl}-1,3-diazepane-2,4-dione (CHEBI:156218) is a piperidines (CHEBI:26151)
(R)-7-{[4-(6-oxo-1,6-dihydropyrimidin-4-yl)piperidin-1-yl]carbonyl}-1,3-diazepane-2,4-dione (CHEBI:156218) is a pyrimidone (CHEBI:38337)
IUPAC Names 
(7R)-7-{[4-(6-oxo-1,6-dihydropyrimidin-4-yl)piperidin-1-yl]carbonyl}-1,3-diazepane-2,4-dione
(7R)-7-[4-(6-oxo-1,6-dihydropyrimidin-4-yl)piperidine-1-carbonyl]-1,3-diazepane-2,4-dione
Synonyms  Source
DB23ChEBI
DB-23ChEBI
(R)-7-(4-(6-oxo-1,6-dihydropyrimidin-4-yl)piperidine-1-carbonyl)-1,3-diazepane-2,4-dioneChEBI
(7R)-7-[[4-(1,6-dihydro-6-oxo-4-pyrimidinyl)-1-piperidinyl]carbonyl]dihydro-1H-1,3-diazepine-2,4(3H,5H)-dioneChEBI
Citations