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CHEBI:8912 - Rugosinone

ChEBI IDCHEBI:8912
ChEBI NameRugosinone
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC19H15NO6
Net Charge0
Average Mass353.330
Monoisotopic Mass353.08994
SMILESCOc1ccc(C(=O)c2nccc3cc4c(cc23)OCO4)c(O)c1OC
InChIInChI=1S/C19H15NO6/c1-23-13-4-3-11(18(22)19(13)24-2)17(21)16-12-8-15-14(25-9-26-15)7-10(12)5-6-20-16/h3-8,22H,9H2,1-2H3
InChIKeyMMPVUYPJIFYAEK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Rugosinone (CHEBI:8912) is a isoquinolines (CHEBI:24922)
Synonym  Source
RugosinoneKEGG COMPOUND
Manual XrefsDatabases
C09634KEGG COMPOUND
C00001913KNApSAcK
C00024767KNApSAcK
Registry NumbersSources
CAS:73609-04-8KEGG COMPOUND