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CHEBI:193925 - 6-({2-[({4,5-dihydroxy-6-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)methyl]-4,5,6-trihydroxyoxan-3-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

ChEBI IDCHEBI:193925
ChEBI Name6-({2-[({4,5-dihydroxy-6-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)methyl]-4,5,6-trihydroxyoxan-3-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H40O20
Net Charge0
Average Mass648.564
Monoisotopic Mass648.21129
SMILESCC1OC(OC2C(OCC3OC(O)C(O)C(O)C3OC3OC(C(=O)O)C(O)C(O)C3O)OC(C)C(O)C2O)C(O)C(O)C1O
WURCSWURCS=2.0/3,4,3/[axxxxh-1x_1-5][axxxxA-1x_1-5][axxxxm-1x_1-5]/1-2-3-3/a4-b1_a6-c1_c2-d1
InChIInChI=1S/C24H40O20/c1-4-7(25)9(27)15(33)22(39-4)44-19-11(29)8(26)5(2)40-24(19)38-3-6-17(13(31)14(32)21(37)41-6)42-23-16(34)10(28)12(30)18(43-23)20(35)36/h4-19,21-34,37H,3H2,1-2H3,(H,35,36)
InChIKeyGUMWIKBARBJINL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
synthetic microbial community (ncbitaxon:3229850) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3129)
ChEBI Ontology
Outgoing Relation(s)
6-({2-[({4,5-dihydroxy-6-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)methyl]-4,5,6-trihydroxyoxan-3-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid (CHEBI:193925) is a oligosaccharide (CHEBI:50699)
IUPAC Name 
6-[2-[[4,5-dihydroxy-6-methyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-4,5,6-trihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid