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CHEBI:226147 - 10-O-[beta-D-(4-methoxyl-glucopyranosyl)]-4-O-methylalternariol

ChEBI IDCHEBI:226147
ChEBI Name10-O-[beta-D-(4-methoxyl-glucopyranosyl)]-4-O-methylalternariol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H24O10
Net Charge0
Average Mass448.424
Monoisotopic Mass448.13695
SMILESCOc1cc(O)c2c(=O)oc3cc(OC4O[C@H](CO)[C@@H](OC)[C@H](O)[C@H]4O)cc(C)c3c2c1
InChIInChI=1S/C22H24O10/c1-9-4-11(30-22-19(26)18(25)20(29-3)15(8-23)32-22)7-14-16(9)12-5-10(28-2)6-13(24)17(12)21(27)31-14/h4-7,15,18-20,22-26H,8H2,1-3H3/t15-,18-,19-,20-,22?/m1/s1
InChIKeyOORJLZQSVIQVMN-AFTBWCONSA-N
Species of MetaboliteComponentSourceComments
Gymnoascus (ncbitaxon:69889) - DOI (10.1016/j.tetlet.2019.05.037)
ChEBI Ontology
Outgoing Relation(s)
10-O-[beta-D-(4-methoxyl-glucopyranosyl)]-4-O-methylalternariol (CHEBI:226147) is a glycoside (CHEBI:24400)
IUPAC Name 
3-[(3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-7-hydroxy-9-methoxy-1-methylbenzo[c]chromen-6-one