Dictyoquinazol A (CHEBI:169764)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Dictyoquinazol A

ChEBI ID	CHEBI:169764

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C17H16N2O4

Net Charge

Average Mass

312.325

Monoisotopic Mass

312.11101

InChI

InChI=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

InChIKey

SHUSJJZZTZAKPD-UHFFFAOYSA-N

SMILES

O(C1=CC(=C(N2C(=O)C3=C(N=C2)C=CC(OC)=C3)C=C1)CO)C

Metabolite of Species	Details
Malus domestica (NCBI:txid3750)	Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study

ChEBI Ontology
Outgoing	Dictyoquinazol A (CHEBI:169764) is a quinazolines (CHEBI:38530)

IUPAC Name

3-[2-(hydroxymethyl)-4-methoxyphenyl]-6-methoxyquinazolin-4-one