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CHEBI:175873 - 3-beta-Cellobiosylglucose

ChEBI IDCHEBI:175873
ChEBI Name3-beta-Cellobiosylglucose
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H32O16
Net Charge0
Average Mass504.438
Monoisotopic Mass504.16903
SMILESOCC1OC(OC2C(CO)OC(OC3C(O)C(O)OC(CO)C3O)C(O)C2O)C(O)C(O)C1O
WURCSWURCS=2.0/1,3,2/[axxxxh-1x_1-5]/1-1-1/a3-b1_b4-c1
InChIInChI=1S/C18H32O16/c19-1-4-7(22)9(24)11(26)17(31-4)33-14-6(3-21)32-18(12(27)10(14)25)34-15-8(23)5(2-20)30-16(29)13(15)28/h4-29H,1-3H2
InChIKeyNLCKNAHSPSUVER-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-beta-Cellobiosylglucose (CHEBI:175873) is a oligosaccharide (CHEBI:50699)
IUPAC Name 
4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,3,5-triol
Manual XrefsDatabases
HMDB0039708HMDB