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CHEBI:224973 - 6-O-alpha-D-ribosyl-8-O-methylasperentin

ChEBI IDCHEBI:224973
ChEBI Name6-O-alpha-D-ribosyl-8-O-methylasperentin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H30O9
Net Charge0
Average Mass438.473
Monoisotopic Mass438.18898
SMILESCOc1cc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc2c1C(=O)O[C@@H](C[C@H]1CCC[C@H](C)O1)C2
InChIInChI=1S/C22H30O9/c1-11-4-3-5-13(28-11)8-14-6-12-7-15(9-16(27-2)18(12)21(26)29-14)30-22-20(25)19(24)17(10-23)31-22/h7,9,11,13-14,17,19-20,22-25H,3-6,8,10H2,1-2H3/t11-,13+,14+,17+,19+,20+,22-/m0/s1
InChIKeyYWXLVYJTSKDZPJ-AMUPPJPJSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (25517217)
ChEBI Ontology
Outgoing Relation(s)
6-O-alpha-D-ribosyl-8-O-methylasperentin (CHEBI:224973) is a glycoside (CHEBI:24400)
IUPAC Name 
(3R)-6-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-8-methoxy-3-[[(2R,6S)-6-methyloxan-2-yl]methyl]-3,4-dihydroisochromen-1-one
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34981218ChemSpider