EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:144129 - Calycin

ChEBI IDCHEBI:144129
ChEBI NameCalycin
Stars
Submittermwilliams
DownloadsMolfile
FormulaC18H10O5
Net Charge0
Average Mass306.273
Monoisotopic Mass306.05282
SMILESO=C1O/C(=C2/C(=O)Oc3ccccc32)C(O)=C1c1ccccc1
InChIInChI=1S/C18H10O5/c19-15-13(10-6-2-1-3-7-10)17(20)23-16(15)14-11-8-4-5-9-12(11)22-18(14)21/h1-9,19H/b16-14+
InChIKeyCGRCGRBHNKRILW-JQIJEIRASA-N
ChEBI Ontology
Outgoing Relation(s)
Calycin (CHEBI:144129) is a benzofurans (CHEBI:35259)