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CHEBI:193854 - 1-methyl 3-(3,4,5,6-tetrahydroxyoxan-2-yl)methyl propanedioate

ChEBI IDCHEBI:193854
ChEBI Name1-methyl 3-(3,4,5,6-tetrahydroxyoxan-2-yl)methyl propanedioate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H16O9
Net Charge0
Average Mass280.229
Monoisotopic Mass280.07943
SMILESCOC(=O)CC(=O)OCC1OC(O)C(O)C(O)C1O
WURCSWURCS=2.0/1,1,0/[axxxxh-1x_1-5_6*OCCCOC/5=O/3=O]/1/
InChIInChI=1S/C10H16O9/c1-17-5(11)2-6(12)18-3-4-7(13)8(14)9(15)10(16)19-4/h4,7-10,13-16H,2-3H2,1H3
InChIKeyCVBNMDZMSXYQHT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
synthetic microbial community (ncbitaxon:3229850) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3129)
ChEBI Ontology
Outgoing Relation(s)
1-methyl 3-(3,4,5,6-tetrahydroxyoxan-2-yl)methyl propanedioate (CHEBI:193854) is a monosaccharide (CHEBI:35381)
IUPAC Name 
1-O-methyl 3-O-[(3,4,5,6-tetrahydroxyoxan-2-yl)methyl] propanedioate