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CHEBI:65143 - β-D-GlcA2S-(1→4)-α-D-GlcNAc6S-(1→4)-D-GlcA

ChEBI IDCHEBI:65143
ChEBI Nameβ-D-GlcA2S-(1→4)-α-D-GlcNAc6S-(1→4)-D-GlcA
Stars
ASCII Namebeta-D-GlcA2S-(1->4)-alpha-D-GlcNAc6S-(1->4)-D-GlcA
DefinitionA linear trisaccharide derivative that consists of 2-sulfated β-D-glucuronic acid, 6-sulfated N-acetyl-α-D-glucosamine and β-D-glucuronic acid units connected in sequence by (1→4)-linkages. An intermediate glycan involved in the degradation of heparan sulfate.
Last Modified12 July 2012
SubmitterBijay
DownloadsMolfile
FormulaC20H31NO24S2
Net Charge0
Average Mass733.585
Monoisotopic Mass733.06774
SMILESCC(=O)N[C@H]1[C@@H](O[C@H]2[C@H](O)[C@@H](O)C(O)O[C@@H]2C(=O)O)O[C@H](COS(=O)(=O)O)[C@@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2OS(=O)(=O)O)[C@@H]1O
InChIInChI=1S/C20H31NO24S2/c1-3(22)21-5-6(23)11(42-20-14(45-47(36,37)38)8(25)7(24)13(44-20)16(28)29)4(2-39-46(33,34)35)40-19(5)43-12-9(26)10(27)18(32)41-15(12)17(30)31/h4-15,18-20,23-27,32H,2H2,1H3,(H,21,22)(H,28,29)(H,30,31)(H,33,34,35)(H,36,37,38)/t4-,5-,6-,7+,8+,9-,10-,11-,12+,13+,14-,15+,18?,19-,20-/m1/s1
InChIKeyFOJGCVQVMIERTM-ZJSBRPKISA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-GlcA2S-(1→4)-α-D-GlcNAc6S-(1→4)-D-GlcA (CHEBI:65143) is a amino trisaccharide (CHEBI:59266)
β-D-GlcA2S-(1→4)-α-D-GlcNAc6S-(1→4)-D-GlcA (CHEBI:65143) is a carbohydrate acid derivative (CHEBI:63436)
β-D-GlcA2S-(1→4)-α-D-GlcNAc6S-(1→4)-D-GlcA (CHEBI:65143) is a oligosaccharide sulfate (CHEBI:37909)
IUPAC Name 
2-O-sulfo-β-D-glucopyranuronosyl-(1→4)-2-acetamido-2-deoxy-6-O-sulfo-α-D-glucopyranosyl-(1→4)-D-glucopyranuronic acid
Synonyms  Source
(GlcA)2 (GlcNAc)1 (S)2KEGG GLYCAN
β-D-GlcpA2S-(1→4)-α-D-GlcpNAc6S-(1→4)-D-GlcpAChEBI
2-O-sulfo-β-D-glucuronosyl-(1→4)-6-O-sulfo-N-acetyl-α-D-glucosaminyl-(1→4)-D-glucuronic acidChEBI
Manual XrefsDatabases
G13039KEGG GLYCAN