CHEBI:8731 - Quinquangulin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Quinquangulin
ChEBI ID CHEBI:8731
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C16H14O5
Net Charge 0
Average Mass 286.280
Monoisotopic Mass 286.08412
InChI InChI=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
InChIKey RWYDRASBOZUJPY-UHFFFAOYSA-N
SMILES COc1cc(O)c2c(O)c3c(cc2c1C)oc(C)cc3=O
ChEBI Ontology
Outgoing Quinquangulin (CHEBI:8731) is a organic heterotricyclic compound (CHEBI:26979)
Quinquangulin (CHEBI:8731) is a organooxygen compound (CHEBI:36963)
Synonym Source
Quinquangulin KEGG COMPOUND
Manual Xrefs Databases
C00002444 KNApSAcK
C09044 KEGG COMPOUND
View more database links
Registry Number Type Source
64894-58-2 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014