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CHEBI:62065 - chondroitin 6'-sulfate anion

ChEBI IDCHEBI:62065
ChEBI Namechondroitin 6'-sulfate anion
Stars
DefinitionA polysaccharide acid oxoanion arising from global deprotonation of the carboxylic and sulfonic acid groups of the repeating units in chondroitin 6'-sulfate; major species at pH 7.3.
Last Modified10 March 2014
SubmitterAnne Morgat
DownloadsMolfile
Formula(C14H19NO14S)n.H2O
Net Charge-2
Average Mass475.381
Monoisotopic Mass475.06429
SMILES[H]O[C@@H]1O[C@H](COS(=O)(=O)[O-])[C@H](O)[C@H](O[C@@H]2O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]2O)[C@H]1NC(C)=O
InChIInChI=1S/C14H23NO15S/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/h4-11,13-14,17-20,23H,2H2,1H3,(H,15,16)(H,21,22)(H,24,25,26)/p-2/t4-,5-,6+,7+,8+,9-,10-,11+,13-,14-/m1/s1
InChIKeyHMCUNCSRFXXUOR-YHCGEDBISA-L
ChEBI Ontology
Outgoing Relation(s)
chondroitin 6'-sulfate anion (CHEBI:62065) has functional parent chondroitin D-glucuronate anion (CHEBI:57652)
chondroitin 6'-sulfate anion (CHEBI:62065) is a polysaccharide acid oxoanion (CHEBI:62196)
chondroitin 6'-sulfate anion (CHEBI:62065) is conjugate base of chondroitin 6'-sulfate (CHEBI:18296)
Incoming Relation(s)
chondroitin 4',6'-disulfate anion (CHEBI:138112) has functional parent chondroitin 6'-sulfate anion (CHEBI:62065)
chondroitin 6'-sulfate (CHEBI:18296) is conjugate acid of chondroitin 6'-sulfate anion (CHEBI:62065)
Synonyms  Source
chondroitin sulfate C anionSUBMITTER
chondroitin 6'-sulfate polyanionChEBI
chondroitin sulfate C polyanionChEBI
UniProt Name  Source
chondroitin 6'-sulfateUniProt