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CHEBI:4353 - Decursin

ChEBI IDCHEBI:4353
ChEBI NameDecursin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC19H20O5
Net Charge0
Average Mass328.364
Monoisotopic Mass328.13107
SMILESCC(C)=CC(=O)O[C@H]1Cc2cc3ccc(=O)oc3cc2OC1(C)C
InChIInChI=1S/C19H20O5/c1-11(2)7-18(21)23-16-9-13-8-12-5-6-17(20)22-14(12)10-15(13)24-19(16,3)4/h5-8,10,16H,9H2,1-4H3/t16-/m0/s1
InChIKeyCUKSFECWKQBVED-INIZCTEOSA-N
ChEBI Ontology
Outgoing Relation(s)
Decursin (CHEBI:4353) is a coumarins (CHEBI:23403)
Synonym  Source
DecursinKEGG COMPOUND
Manual XrefsDatabases
C09258KEGG COMPOUND
C00002465KNApSAcK
Registry NumbersSources
CAS:5928-25-6KEGG COMPOUND