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CHEBI:152163 - β-D-Galp6S-(1→4)-D-Glcp

Default Structure
ChEBI IDCHEBI:152163
ChEBI Nameβ-D-Galp6S-(1→4)-D-Glcp
Stars
ASCII Namebeta-D-Galp6S-(1->4)-D-Glcp
DefinitionA disaccharide derivative that is lactose in which the hydroxy group at position 6 of the galactopyranose ring has been converted into the corresponding hydrogen sulfate derivative.
Last Modified21 July 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC12H22O14S
Net Charge0
Average Mass422.361
Monoisotopic Mass422.07303
SMILESO=S(=O)(O)OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)C(O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O
WURCSWURCS=2.0/2,2,1/[a2122h-1x_1-5][a2112h-1b_1-5_6*OSO/3=O/3=O]/1-2/a4-b1
InChIInChI=1S/C12H22O14S/c13-1-3-10(7(16)8(17)11(19)24-3)26-12-9(18)6(15)5(14)4(25-12)2-23-27(20,21)22/h3-19H,1-2H2,(H,20,21,22)/t3-,4-,5+,6+,7-,8-,9-,10-,11?,12+/m1/s1
InChIKeyNEVLAHFUHIDOLO-QKKXKWKRSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-Galp6S-(1→4)-D-Glcp (CHEBI:152163) has functional parent lactose (CHEBI:17716)
β-D-Galp6S-(1→4)-D-Glcp (CHEBI:152163) is a disaccharide derivative (CHEBI:63353)
β-D-Galp6S-(1→4)-D-Glcp (CHEBI:152163) is a oligosaccharide sulfate (CHEBI:37909)
IUPAC Names 
4-O-(6-O-sulfo-β-D-galactopyranosyl)-D-glucopyranose
Gal6S(b1-4)Glc
Synonyms  Source
[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methyl hydrogen sulfateIUPAC
6-O-sulfo-β-D-galacto-hexopyranosyl-(1→4)-D-gluco-hexopyranoseIUPAC
lactose 6'-sulfateChEBI
Manual XrefsDatabases
G09439KEGG GLYCAN
G60492QFGlyGen
G60492QFGlyTouCan
Registry NumbersSources
CAS:1015758-24-3ChEBI