EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:146064 - β-D-GlcA3S-(1→4)-D-Xylp

ChEBI IDCHEBI:146064
ChEBI Nameβ-D-GlcA3S-(1→4)-D-Xylp
Stars
ASCII Namebeta-D-GlcA3S-(1->4)-D-Xylp
DefinitionA disaccharide derivative consisting of 3-O-sulfo-β-D-glucopyranuronic acid and D-xylopyranose joined by a (1→4) glycosidic linkage.
Last Modified12 February 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC11H18O14S
Net Charge0
Average Mass406.318
Monoisotopic Mass406.04173
SMILESO=C(O)[C@H]1O[C@@H](O[C@@H]2COC(O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](OS(=O)(=O)O)[C@@H]1O
WURCSWURCS=2.0/2,2,1/[a212h-1x_1-5][a2122A-1b_1-5_3*OSO/3=O/3=O]/1-2/a4-b1
InChIInChI=1S/C11H18O14S/c12-3-2(1-22-10(18)4(3)13)23-11-6(15)7(25-26(19,20)21)5(14)8(24-11)9(16)17/h2-8,10-15,18H,1H2,(H,16,17)(H,19,20,21)/t2-,3+,4-,5+,6-,7+,8+,10?,11-/m1/s1
InChIKeyQRGLTVKAZBZWSD-DJOZHRAESA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-GlcA3S-(1→4)-D-Xylp (CHEBI:146064) is a disaccharide derivative (CHEBI:63353)
β-D-GlcA3S-(1→4)-D-Xylp (CHEBI:146064) is a glucosiduronic acid (CHEBI:24302)
β-D-GlcA3S-(1→4)-D-Xylp (CHEBI:146064) is a oligosaccharide sulfate (CHEBI:37909)
IUPAC Names 
GlcA3S(b1-4)Xyl
4-O-(3-O-sulfo-β-D-glucopyranuronosyl)-D-xylopyranose
Synonyms  Source
3-O-sulfo-β-D-gluco-hexopyranosyluronic acid-(1→4)-D-xylo-pentopyranoseIUPAC
(2S,3R,4S,5R,6R)-3,5-dihydroxy-4-sulfooxy-6-[(3R,4R,5R)-4,5,6-trihydroxyoxan-3-yl]oxyoxane-2-carboxylic acidIUPAC
Manual XrefsDatabases
G00194ZLGlyTouCan
G00194ZLGlyGen