CHEBI:137065 - β-D-GlcA3S-(1→3)-β-D-Gal-(1→4)-D-GlcNAc(2−)

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ChEBI Name β-D-GlcA3S-(1→3)-β-D-Gal-(1→4)-D-GlcNAc(2−)
ChEBI ID CHEBI:137065
ChEBI ASCII Name beta-D-GlcA3S-(1->3)-beta-D-Gal-(1->4)-D-GlcNAc(2-)
Definition The carbohydrate acid derivative anion formed from β-D-GlcA3S-(1→3)-β-D-Gal-(1→4)-D-GlcNAc by loss of two protons, one from each of its sulfo and carboxy groups.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C20H31NO20S
Net Charge -2
Average Mass 637.522
Monoisotopic Mass 637.11711
InChI InChI=1S/C20H33NO20S/c1-4(24)21-7-9(26)13(6(3-23)36-18(7)32)38-19-11(28)14(8(25)5(2-22)37-19)39-20-12(29)15(41-42(33,34)35)10(27)16(40-20)17(30)31/h5-16,18-20,22-23,25-29,32H,2-3H2,1H3,(H,21,24)(H,30,31)(H,33,34,35)/p-2/t5-,6-,7-,8+,9-,10+,11-,12-,13-,14+,15+,16+,18?,19+,20-/m1/s1
InChIKey AKXIYZBZYOTHPH-SKSRJFFGSA-L
SMILES OC1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C([O-])=O)O)OS(=O)(=O)[O-])O)O)O)NC(=O)C
ChEBI Ontology
Outgoing β-D-GlcA3S-(1→3)-β-D-Gal-(1→4)-D-GlcNAc(2−) (CHEBI:137065) is a carbohydrate acid derivative anion (CHEBI:63551)
β-D-GlcA3S-(1→3)-β-D-Gal-(1→4)-D-GlcNAc(2−) (CHEBI:137065) is a organosulfate oxoanion (CHEBI:58958)
β-D-GlcA3S-(1→3)-β-D-Gal-(1→4)-D-GlcNAc(2−) (CHEBI:137065) is conjugate base of β-D-GlcA3S-(1→3)-β-D-Gal-(1→4)-D-GlcNAc (CHEBI:60322)
Incoming Na2[β-D-GlcA3S-(1→3)-β-D-Gal-(1→4)-D-GlcNAc] (CHEBI:137066) has part β-D-GlcA3S-(1→3)-β-D-Gal-(1→4)-D-GlcNAc(2−) (CHEBI:137065)
β-D-GlcA3S-(1→3)-β-D-Gal-(1→4)-D-GlcNAc (CHEBI:60322) is conjugate acid of β-D-GlcA3S-(1→3)-β-D-Gal-(1→4)-D-GlcNAc(2−) (CHEBI:137065)
IUPAC Name
3-O-sulfonato-β-D-glucopyranosyluronate-(1→3)-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-D-glucopyranose
Synonyms Sources
3-O-sulfonato-β-D-glucopyranuronosyl-(1→3)-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-D-glucopyranose JCBN
3-O-sulfonato-β-D-glucosyluronate-(1→3)-β-D-galactosyl-(1→4)-N-acetyl-D-glucosamine ChEBI
β-D-GlcpA3S-(1→3)-β-D-Galp-(1→4)-D-GlcpNAc(2−) ChEBI
HNK-1 dianion ChEBI
human natural killer cell-1 epitope ChEBI
Citation Waiting for Citations Type Source
28403522 PubMed citation Europe PMC
Last Modified
07 July 2017