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CHEBI:185394 - 6-({2-[({4,5-dihydroxy-6-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)methyl]-3,5,6-trihydroxyoxan-4-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

ChEBI IDCHEBI:185394
ChEBI Name6-({2-[({4,5-dihydroxy-6-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)methyl]-3,5,6-trihydroxyoxan-4-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(OC4OC(C(=O)O)C(O)C(O)C4O)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/a3-b1_a6-c1_c2-d1
InChIInChI=1S/C24H40O20/c1-4-7(25)10(28)14(32)22(39-4)44-19-12(30)8(26)5(2)40-24(19)38-3-6-9(27)17(16(34)21(37)41-6)42-23-15(33)11(29)13(31)18(43-23)20(35)36/h4-19,21-34,37H,3H2,1-2H3,(H,35,36)
InChIKeyGEUPLUZCYCACLM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913) spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein [LBO:0000132]
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]-3,5,6-trihydroxyoxan-4-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid (CHEBI:185394) 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]-3,5,6-trihydroxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0127466HMDB