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CHEBI:197837 - Aurantiomide C

ChEBI IDCHEBI:197837
ChEBI NameAurantiomide C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H20N4O3
Net Charge0
Average Mass340.383
Monoisotopic Mass340.15354
SMILESCC(C)/C=C1\NC(=O)[C@H](CCC(N)=O)n2c1nc1ccccc1c2=O
InChIInChI=1S/C18H20N4O3/c1-10(2)9-13-16-20-12-6-4-3-5-11(12)18(25)22(16)14(17(24)21-13)7-8-15(19)23/h3-6,9-10,14H,7-8H2,1-2H3,(H2,19,23)(H,21,24)/b13-9-/t14-/m0/s1
InChIKeyUKYRPVOCKVERNT-XXYUJHKVSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (17455978)
ChEBI Ontology
Outgoing Relation(s)
Aurantiomide C (CHEBI:197837) is a quinazolines (CHEBI:38530)
IUPAC Name 
3-[(1Z,4S)-1-(2-methylpropylidene)-3,6-dioxo-4H-pyrazino[2,1-b]quinazolin-4-yl]propanamide
Manual XrefsDatabases
17613454ChemSpider