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CHEBI:203770 - Aurantiomide B

ChEBI IDCHEBI:203770
ChEBI NameAurantiomide B
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SubmitterMetaboLights
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FormulaC18H22N4O4
Net Charge0
Average Mass358.398
Monoisotopic Mass358.16411
SMILESCC(C)C[C@]1(O)NC(=O)[C@H](CCC(N)=O)n2c1nc1ccccc1c2=O
InChIInChI=1S/C18H22N4O4/c1-10(2)9-18(26)17-20-12-6-4-3-5-11(12)16(25)22(17)13(15(24)21-18)7-8-14(19)23/h3-6,10,13,26H,7-9H2,1-2H3,(H2,19,23)(H,21,24)/t13-,18+/m0/s1
InChIKeyVZHFOIYILDANRZ-SCLBCKFNSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (17455978)
ChEBI Ontology
Outgoing Relation(s)
Aurantiomide B (CHEBI:203770) is a quinazolines (CHEBI:38530)
IUPAC Name 
3-[(1R,4S)-1-hydroxy-1-(2-methylpropyl)-3,6-dioxo-2,4-dihydropyrazino[2,1-b]quinazolin-4-yl]propanamide
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17613453ChemSpider