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CHEBI:82581 - 6-[2,3-Dihydroxy-1-(hydroxymethyl)propyl]-1,2-dihydro-7-hydroxy-9-methoxy-cyclopenta[c][1]benzopyran-3,4-dione

ChEBI IDCHEBI:82581
ChEBI Name6-[2,3-Dihydroxy-1-(hydroxymethyl)propyl]-1,2-dihydro-7-hydroxy-9-methoxy-cyclopenta[c][1]benzopyran-3,4-dione
Stars
DownloadsMolfile
FormulaC17H18O8
Net Charge0
Average Mass350.323
Monoisotopic Mass350.10017
SMILESCOc1cc(O)c(C(CO)C(O)CO)c2oc(=O)c3c(c12)CCC3=O
InChIInChI=1S/C17H18O8/c1-24-12-4-10(21)13(8(5-18)11(22)6-19)16-15(12)7-2-3-9(20)14(7)17(23)25-16/h4,8,11,18-19,21-22H,2-3,5-6H2,1H3
InChIKeyOKGOPKLFGPTQFQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-[2,3-Dihydroxy-1-(hydroxymethyl)propyl]-1,2-dihydro-7-hydroxy-9-methoxy-cyclopenta[c][1]benzopyran-3,4-dione (CHEBI:82581) is a coumarins (CHEBI:23403)
Manual XrefsDatabases
C19590KEGG COMPOUND
HMDB0062427HMDB