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CHEBI:185822 - 6,7-Dimethyl-9-(2-acetoxyethyl)isoalloxazine

ChEBI IDCHEBI:185822
ChEBI Name6,7-Dimethyl-9-(2-acetoxyethyl)isoalloxazine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16N4O4
Net Charge0
Average Mass328.328
Monoisotopic Mass328.11715
SMILESCC(=O)OCCn1c2nc(=O)nc(=O)c-2nc2cc(C)c(C)cc21
InChIInChI=1S/C16H16N4O4/c1-8-6-11-12(7-9(8)2)20(4-5-24-10(3)21)14-13(17-11)15(22)19-16(23)18-14/h6-7H,4-5H2,1-3H3,(H,19,22,23)
InChIKeyPVRDHKBVCDWVPD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
6,7-Dimethyl-9-(2-acetoxyethyl)isoalloxazine (CHEBI:185822) is a flavin (CHEBI:30527)
IUPAC Name 
2-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)ethyl acetate
Manual XrefsDatabases
21222ChemSpider
Registry NumbersSources
CAS:6266-58-6ChemIDplus