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CHEBI:7570 - nigerose

ChEBI IDCHEBI:7570
ChEBI Namenigerose
Stars
DefinitionA glycosylglucose consisting of D-glucose with undefined anomeric stereochemistry and an α-D-glucosyl residue attached at the 3-position.
Last Modified23 May 2020
DownloadsMolfile
FormulaC12H22O11
Net Charge0
Average Mass342.297
Monoisotopic Mass342.11621
SMILESOC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](CO)OC(O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
WURCSWURCS=2.0/2,2,1/[a2122h-1x_1-5][a2122h-1a_1-5]/1-2/a3-b1
InChIInChI=1S/C12H22O11/c13-1-3-5(15)7(17)8(18)12(22-3)23-10-6(16)4(2-14)21-11(20)9(10)19/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8-,9-,10+,11?,12-/m1/s1
InChIKeyQIGJYVCQYDKYDW-NSYYTRPSSA-N
Wikipedia
ChEBI Ontology
Outgoing Relation(s)
nigerose (CHEBI:7570) is a glycosylglucose (CHEBI:24405)
Incoming Relation(s)
cyclobis-(1→6)-α-nigerosyl (CHEBI:136822) has functional parent nigerose (CHEBI:7570)
α-D-Glcp-(1→3)-?-D-Glcp-(1→2)-β-D-Glcp (CHEBI:148655) has functional parent nigerose (CHEBI:7570)
α-D-Glcp-(1→3)-[α-D-Glcp-(1→4)]-D-Glcp (CHEBI:148380) has functional parent nigerose (CHEBI:7570)
α-D-Glcp-(1→4)-α-D-Glcp-(1→3)-D-Glcp (CHEBI:146798) has functional parent nigerose (CHEBI:7570)
IUPAC Name 
α-D-glucopyranosyl-(1→3)-D-glucopyranose
Synonyms  Source
3-O-α-D-glucopyranosyl-D-glucopyranoseIUPAC
NigeroseKEGG COMPOUND
SakebioseKEGG COMPOUND
α-D-Glup-(1→3)-D-GluJCBN
α-D-Glup-(1→3)-D-GlupChEBI
UniProt Name  Source
nigeroseUniProt
Manual XrefsDatabases
3-BETA-D-GLUCOSYLGLUCOSEMetaCyc
C01518KEGG COMPOUND
NGRPDBeChem
NigeroseWikipedia
Registry NumbersSources
Reaxys:1292732Reaxys
CAS:497-48-3KEGG COMPOUND
Citations