CHEBI:147148 - α-L-threo-hex-4-enopyranuronosyl-(1→3)-β-D-GalpNAc6S

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name α-L-threo-hex-4-enopyranuronosyl-(1→3)-β-D-GalpNAc6S
ChEBI ID CHEBI:147148
ChEBI ASCII Name alpha-L-threo-hex-4-enopyranuronosyl-(1->3)-beta-D-GalpNAc6S
Definition An aminodisaccharide that is 2-acetamido-2-deoxy-6-O-sulfo-β-D-galactopyranose in which the hydroxy group at position 3 has been glycosylated by an α-L-threo-hex-4-enopyranosiduronic acid group.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Gareth Owen
Supplier Information
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Formula C14H21NO15S
Net Charge 0
Average Mass 475.370
Monoisotopic Mass 475.06319
InChI InChI=1S/C14H21NO15S/c1-3(16)15-5-10(6(17)4(28-13(5)23)2-27-31(24,25)26)29-14-9(20)7(18)8(19)11(30-14)12(21)22/h4-7,9-10,13-14,17-20,23H,2H2,1H3,(H,15,16)(H,21,22)(H,24,25,26)/t4-,5-,6+,7+,9-,10-,13-,14-/m1/s1
InChIKey ALHQVWMGDDOQDZ-MIPSCPIWSA-N
SMILES O1[C@@H]([C@H](O)[C@H](O[C@@H]2OC(=C(O)[C@H](O)[C@H]2O)C(O)=O)[C@@H](NC(=O)C)[C@@H]1O)COS(O)(=O)=O
ChEBI Ontology
Outgoing α-L-threo-hex-4-enopyranuronosyl-(1→3)-β-D-GalpNAc6S (CHEBI:147148) is a amino disaccharide (CHEBI:22480)
α-L-threo-hex-4-enopyranuronosyl-(1→3)-β-D-GalpNAc6S (CHEBI:147148) is a oligosaccharide sulfate (CHEBI:37909)
IUPAC Name
2-acetamido-2-deoxy-3-O-α-L-threo-hex-4-enopyranuronosyl-6-O-sulfo-β-D-galactopyranose
Synonyms Sources
(2R,3R,4R)-2-[(2R,3R,4R,5R,6R)-3-acetamido-2,5-dihydroxy-6-(sulfooxymethyl)oxan-4-yl]oxy-3,4,5-trihydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC
WURCS=2.0/2,2,1/[a2112h-1b_1-5_2*NCC/3=O_6*OSO/3=O/3=O][a21EEA-1a_1-5]/1-2/a3-b1 SUBMITTER
Manual Xrefs Databases
G10417PV GlyTouCan
G10417PV GlyGen
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Last Modified
01 April 2020