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CHEBI:226268 - 1-O-methyl-6-O-(alpha-D-ribofuranosyl)emodin

ChEBI IDCHEBI:226268
ChEBI Name1-O-methyl-6-O-(alpha-D-ribofuranosyl)emodin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H20O9
Net Charge0
Average Mass416.382
Monoisotopic Mass416.11073
SMILESCOc1cc(C)cc2c1C(=O)c1c(O)cc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc1C2=O
InChIInChI=1S/C21H20O9/c1-8-3-10-16(13(4-8)28-2)19(26)15-11(17(10)24)5-9(6-12(15)23)29-21-20(27)18(25)14(7-22)30-21/h3-6,14,18,20-23,25,27H,7H2,1-2H3/t14-,18-,20-,21+/m1/s1
InChIKeyYSOKOLXNOPRZHN-STCFGPAYSA-N
Species of MetaboliteComponentSourceComments
Gaeumannomyces (ncbitaxon:29849) - PubMed (28352106)
ChEBI Ontology
Outgoing Relation(s)
1-O-methyl-6-O-(alpha-D-ribofuranosyl)emodin (CHEBI:226268) is a anthraquinone (CHEBI:22580)
IUPAC Name 
3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-1-hydroxy-8-methoxy-6-methylanthracene-9,10-dione
Manual XrefsDatabases
61708585ChemSpider