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CHEBI:199650 - 4′-O-beta-D-galactopyranosyl djalonensone

ChEBI IDCHEBI:199650
ChEBI Name4′-O-beta-D-galactopyranosyl djalonensone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22O10
Net Charge0
Average Mass434.397
Monoisotopic Mass434.12130
SMILESCOc1cc(C)c2c(c1)oc(=O)c1c(O)cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc12
InChIInChI=1S/C21H22O10/c1-8-3-9(28-2)6-13-15(8)11-4-10(5-12(23)16(11)20(27)30-13)29-21-19(26)18(25)17(24)14(7-22)31-21/h3-6,14,17-19,21-26H,7H2,1-2H3/t14-,17+,18+,19-,21-/m1/s1
InChIKeyDCYCTHAKHYSDFS-ZLZXIGQQSA-N
ChEBI Ontology
Outgoing Relation(s)
4′-O-beta-D-galactopyranosyl djalonensone (CHEBI:199650) is a glycoside (CHEBI:24400)
IUPAC Name 
7-hydroxy-3-methoxy-1-methyl-9-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzo[c]chromen-6-one
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