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CHEBI:170087 - Hallacridone

ChEBI IDCHEBI:170087
ChEBI NameHallacridone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H13NO4
Net Charge0
Average Mass307.305
Monoisotopic Mass307.08446
SMILESCC(=O)c1cc2c(cc(O)c3c(=O)c4ccccc4n(C)c32)o1
InChIInChI=1S/C18H13NO4/c1-9(20)14-7-11-15(23-14)8-13(21)16-17(11)19(2)12-6-4-3-5-10(12)18(16)22/h3-8,21H,1-2H3
InChIKeyGZVRDNACRGJZNW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
ChEBI Ontology
Outgoing Relation(s)
Hallacridone (CHEBI:170087) has functional parent acridone (CHEBI:50756)
Hallacridone (CHEBI:170087) is a acridines (CHEBI:22213)
IUPAC Name 
2-acetyl-5-hydroxy-11-methyluro[2,3-c]acridin-6-one
Manual XrefsDatabases
HMDB0029826HMDB
30776794ChemSpider