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CHEBI:8731 - Quinquangulin

ChEBI IDCHEBI:8731
ChEBI NameQuinquangulin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC16H14O5
Net Charge0
Average Mass286.283
Monoisotopic Mass286.08412
SMILESCOc1cc(O)c2c(O)c3c(=O)cc(C)oc3cc2c1C
InChIInChI=1S/C16H14O5/c1-7-4-10(17)15-13(21-7)5-9-8(2)12(20-3)6-11(18)14(9)16(15)19/h4-6,18-19H,1-3H3
InChIKeyRWYDRASBOZUJPY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Quinquangulin (CHEBI:8731) is a organic heterotricyclic compound (CHEBI:26979)
Quinquangulin (CHEBI:8731) is a organooxygen compound (CHEBI:36963)
Synonym  Source
QuinquangulinKEGG COMPOUND
Manual XrefsDatabases
C09044KEGG COMPOUND
C00002444KNApSAcK
Registry NumbersSources
CAS:64894-58-2KEGG COMPOUND