CHEBI:184441 - 3,4,5-Trihydroxy-6-[N-(5-methyl-1,2-oxazol-3-yl)4-aminobenzenesulfonamido]oxane-2-carboxylic acid

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ChEBI Name 3,4,5-Trihydroxy-6-[N-(5-methyl-1,2-oxazol-3-yl)4-aminobenzenesulfonamido]oxane-2-carboxylic acid
ChEBI ID CHEBI:184441
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H19N3O9S
Net Charge 0
Average Mass 429.400
Monoisotopic Mass 429.08420
InChI InChI=1S/C16H19N3O9S/c1-7-6-10(18-28-7)19(29(25,26)9-4-2-8(17)3-5-9)15-13(22)11(20)12(21)14(27-15)16(23)24/h2-6,11-15,20-22H,17H2,1H3,(H,23,24)
InChIKey BLFOMTRQSZIMKK-UHFFFAOYSA-N
SMILES S(=O)(=O)(N(C1OC(C(O)C(O)C1O)C(O)=O)C2=NOC(=C2)C)C3=CC=C(N)C=C3
Metabolite of Species Details
Bos taurus (NCBI:txid9913) Found in spermatozoon (BTO:0001277). of strain Holstein [LBO:0000132] See: MetaboLights Study
ChEBI Ontology
Outgoing 3,4,5-Trihydroxy-6-[N-(5-methyl-1,2-oxazol-3-yl)4-aminobenzenesulfonamido]oxane-2-carboxylic acid (CHEBI:184441) is a N-glycosyl compound (CHEBI:21731)
IUPAC Name
6-[(4-aminophenyl)sulonyl-(5-methyl-1,2-oxazol-3-yl)amino]-3,4,5-trihydroxyoxane-2-carboxylic acid
Manual Xrefs Databases
28573043 ChemSpider
HMDB0013855 HMDB
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