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CHEBI:169764 - Dictyoquinazol A

ChEBI IDCHEBI:169764
ChEBI NameDictyoquinazol A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H16N2O4
Net Charge0
Average Mass312.325
Monoisotopic Mass312.11101
SMILESCOc1ccc(-n2cnc3ccc(OC)cc3c2=O)c(CO)c1
InChIInChI=1S/C17H16N2O4/c1-22-12-4-6-16(11(7-12)9-20)19-10-18-15-5-3-13(23-2)8-14(15)17(19)21/h3-8,10,20H,9H2,1-2H3
InChIKeySHUSJJZZTZAKPD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Dictyoquinazol A (CHEBI:169764) is a quinazolines (CHEBI:38530)
IUPAC Name 
3-[2-(hydroxymethyl)-4-methoxyphenyl]-6-methoxyquinazolin-4-one
Manual XrefsDatabases
HMDB0040435HMDB
552712ChemSpider