CHEBI:36229 - allolactose

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ChEBI Name allolactose
ChEBI ID CHEBI:36229
Definition A glycosylglucose consisting of galactose and glucose units linked through a 1-6 glycosidic linkage.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C12H22O11
Net Charge 0
Average Mass 342.297
Monoisotopic Mass 342.11621
InChI InChI=1S/C12H22O11/c13-1-3-5(14)8(17)10(19)12(23-3)21-2-4-6(15)7(16)9(18)11(20)22-4/h3-20H,1-2H2/t3-,4-,5+,6-,7+,8+,9-,10-,11?,12-/m1/s1
InChIKey DLRVVLDZNNYCBX-VDGMBKLFSA-N
SMILES OC[C@H]1O[C@@H](OC[C@H]2OC(O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O
Metabolite of Species Details
Escherichia coli (NCBI:txid562) See: PubMed
Roles Classification
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
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ChEBI Ontology
Outgoing allolactose (CHEBI:36229) has role Escherichia coli metabolite (CHEBI:76971)
allolactose (CHEBI:36229) is a glycosylglucose (CHEBI:24405)
Incoming β-D-Galp-(1→2)-[β-D-Galp-(1→6)]-D-Glcp (CHEBI:147518) has functional parent allolactose (CHEBI:36229)
α-allolactose (CHEBI:36231) is a allolactose (CHEBI:36229)
β-allolactose (CHEBI:36230) is a allolactose (CHEBI:36229)
IUPAC Names
β-D-galactopyranosyl-(1→6)-D-glucopyranose
Gal(b1-6)Glc
Synonyms Sources
6-O-β-D-galactopyranosyl-D-glucopyranose ChemIDplus
allolactose ChemIDplus
β-D-galacto-hexopyranosyl-(1→6)-D-gluco-hexopyranose IUPAC
β-D-Galp-(1→6)-D-Glcp IUPAC
WURCS=2.0/2,2,1/[a2122h-1x_1-5][a2112h-1b_1-5]/1-2/a6-b1 GlyTouCan
Manual Xrefs Databases
Allolactose Wikipedia
DB04116 DrugBank
G00835 KEGG GLYCAN
G44856HU GlyTouCan
G44856HU GlyGen
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Registry Numbers Types Sources
1292777 Reaxys Registry Number Reaxys
1292777 Beilstein Registry Number Beilstein
645-03-4 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
24128493 PubMed citation Europe PMC
241475 PubMed citation Europe PMC
Last Modified
18 November 2020