CHEBI:83963 - 2-acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranosyluronate)-4-O-sulfonato-D-galactopyranose(2−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranosyluronate)-4-O-sulfonato-D-galactopyranose(2−)
ChEBI ID CHEBI:83963
ChEBI ASCII Name 2-acetamido-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranosyluronate)-4-O-sulfonato-D-galactopyranose(2-)
Definition A carbohydrate acid derivative anion resulting from the removal of a proton from the carboxy and sulfate groups of 2-acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranosyluronic acid)-4-O-sulfo-D-galactopyranose arising from deprotonation of carboxylic acid and sulfate functions.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C14H19NO14S
Net Charge -2
Average Mass 457.36500
Monoisotopic Mass 457.05372
InChI InChI=1S/C14H21NO14S/c1-4(17)15-8-11(10(29-30(23,24)25)7(3-16)26-13(8)22)28-14-9(19)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)/p-2/t5-,7+,8+,9+,10-,11+,13?,14-/m0/s1
InChIKey BWBRFVRXCBBDEH-ZTVLJYEESA-L
SMILES CC(=O)N[C@H]1C(O)O[C@H](CO)[C@H](OS([O-])(=O)=O)[C@@H]1O[C@@H]1OC(=C[C@H](O)[C@H]1O)C([O-])=O
ChEBI Ontology
Outgoing 2-acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranosyluronate)-4-O-sulfonato-D-galactopyranose(2−) (CHEBI:83963) is a carbohydrate acid derivative anion (CHEBI:63551)
2-acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranosyluronate)-4-O-sulfonato-D-galactopyranose(2−) (CHEBI:83963) is a monocarboxylic acid anion (CHEBI:35757)
2-acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranosyluronate)-4-O-sulfonato-D-galactopyranose(2−) (CHEBI:83963) is a organosulfate oxoanion (CHEBI:58958)
2-acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranosyluronate)-4-O-sulfonato-D-galactopyranose(2−) (CHEBI:83963) is conjugate base of 2-acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranosyluronic acid)-4-O-sulfo-D-galactopyranose (CHEBI:15931)
Incoming 2-acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranosyluronate)-4-O-sulfonato-β-D-galactopyranose(2−) (CHEBI:57571) is a 2-acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranosyluronate)-4-O-sulfonato-D-galactopyranose(2−) (CHEBI:83963)
2-acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranosyluronic acid)-4-O-sulfo-D-galactopyranose (CHEBI:15931) is conjugate acid of 2-acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranosyluronate)-4-O-sulfonato-D-galactopyranose(2−) (CHEBI:83963)
IUPAC Name
2-acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranuronosyl)-4-O-sulfonato-D-galactopyranose
Synonym Source
4-deoxy-β-D-gluc-4-enuronosyl-(1→3)-N-acetyl-D-galactosamine 4-sulfate UniProt
Last Modified
19 February 2015