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CHEBI:63271 - 4-deoxy-Δ4-β-D-GlcpA2S-(1→3)-β-D-GalpNAc

ChEBI IDCHEBI:63271
ChEBI Name4-deoxy-Δ4-β-D-GlcpA2S-(1→3)-β-D-GalpNAc
Stars
ASCII Name4-deoxy-Delta(4)-beta-D-GlcpA2S-(1->3)-beta-D-GalpNAc
DefinitionAn oligosaccharide sulfate that is 2-acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranuronosyl)-β-D-galactopyranose in which the hydroxy group at position 2 of the 4-deoxy-hex-4-enopyranuronosyl moiety is converted to the corresponding sulfate derivative.
Last Modified26 May 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC14H21NO14S
Net Charge0
Average Mass459.382
Monoisotopic Mass459.06828
SMILESCC(=O)N[C@@H]1[C@@H](O[C@@H]2OC(C(=O)O)=C[C@H](O)[C@H]2OS(=O)(=O)O)[C@@H](O)[C@@H](CO)O[C@H]1O
InChIInChI=1S/C14H21NO14S/c1-4(17)15-8-11(9(19)7(3-16)26-13(8)22)28-14-10(29-30(23,24)25)5(18)2-6(27-14)12(20)21/h2,5,7-11,13-14,16,18-19,22H,3H2,1H3,(H,15,17)(H,20,21)(H,23,24,25)/t5-,7+,8+,9-,10+,11+,13+,14-/m0/s1
InChIKeyZEUCJYOQJTZLFJ-RBCDGZSOSA-N
ChEBI Ontology
Outgoing Relation(s)
4-deoxy-Δ4-β-D-GlcpA2S-(1→3)-β-D-GalpNAc (CHEBI:63271) has functional parent β-D-4-deoxy-Δ4-GlcpA-(1→3)-β-D-GalpNAc (CHEBI:46280)
4-deoxy-Δ4-β-D-GlcpA2S-(1→3)-β-D-GalpNAc (CHEBI:63271) is a oligosaccharide sulfate (CHEBI:37909)
4-deoxy-Δ4-β-D-GlcpA2S-(1→3)-β-D-GalpNAc (CHEBI:63271) is conjugate acid of 4-deoxy-Δ4-β-D-GlcpA2S-(1→3)-β-D-GalpNAc(2−) (CHEBI:63274)
Incoming Relation(s)
Δ4-β-D-GlcpA2S-(1→3)-β-D-GalpNAc6S (CHEBI:146596) has functional parent 4-deoxy-Δ4-β-D-GlcpA2S-(1→3)-β-D-GalpNAc (CHEBI:63271)
4-deoxy-Δ4-β-D-GlcpA2S-(1→3)-β-D-GalpNAc(2−) (CHEBI:63274) is conjugate base of 4-deoxy-Δ4-β-D-GlcpA2S-(1→3)-β-D-GalpNAc (CHEBI:63271)
IUPAC Name 
2-acetamido-2-deoxy-3-O-(4-deoxy-2-O-sulfo-α-L-threo-hex-4-enopyranuronosyl)-β-D-galactopyranose
Synonym  Source
2-(acetylamino)-2-deoxy-3-O-(4-deoxy-2-O-sulfo-α-L-threo-hex-4-enopyranuronosyl)-β-D-galactopyranoseChEBI
Citations