CHEBI:165235 - N-Acetylgalactosamine 6-sulfate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name N-Acetylgalactosamine 6-sulfate
ChEBI ID CHEBI:165235
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C8H15NO9S
Net Charge 0
Average Mass 301.270
Monoisotopic Mass 301.04675
InChI InChI=1S/C8H15NO9S/c1-4(11)9-5(2-10)7(13)8(14)6(12)3-18-19(15,16)17/h2,5-8,12-14H,3H2,1H3,(H,9,11)(H,15,16,17)/t5-,6+,7+,8-/m0/s1
InChIKey NHZWETQZLORZIR-OSMVPFSASA-N
SMILES S(OC[C@@H](O)[C@H](O)[C@H](O)[C@@H](NC(=O)C)C=O)(O)(=O)=O
ChEBI Ontology
Outgoing N-Acetylgalactosamine 6-sulfate (CHEBI:165235) is a monosaccharide sulfate (CHEBI:24589)
IUPAC Name
[(2R,3R,4R,5R)-5-acetamido-2,3,4-trihydroxy-6-oxohexyl] hydrogen sulate
Manual Xrefs Databases
167877 ChemSpider
HMDB0000841 HMDB
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Registry Number Type Source
10357-00-3 CAS Registry Number ChemIDplus