CHEBI:143469 - 1-[(3S,4R,5R,6R)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]-3-(4-acetamidobenzenesulfonamido)-2-phenyl-1lambda5-pyrazol-1-ylium

ChEBI IDCHEBI:143469
ChEBI Name1-[(3S,4R,5R,6R)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]-3-(4-acetamidobenzenesulfonamido)-2-phenyl-1lambda5-pyrazol-1-ylium
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Last Modified27 February 2024
Submittermwilliams
DownloadsMolfile
FormulaC23H25N4O9S
Net Charge+1
Average Mass533.539
Monoisotopic Mass533.13368
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2cc[n+](C3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)n2-c2ccccc2)cc1
InChIInChI=1S/C23H24N4O9S/c1-13(28)24-14-7-9-16(10-8-14)37(34,35)25-17-11-12-26(27(17)15-5-3-2-4-6-15)22-20(31)18(29)19(30)21(36-22)23(32)33/h2-12,18-22,29-31H,1H3,(H2,24,28,32,33)/p+1/t18-,19-,20+,21-,22?/m0/s1
InChIKeyVFIUCIMNWVNBGY-ZWWRZYQRSA-O
ChEBI Ontology
Outgoing Relation(s)
1-[(3S,4R,5R,6R)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]-3-(4-acetamidobenzenesulfonamido)-2-phenyl-1lambda5-pyrazol-1-ylium (CHEBI:143469) is a organic cation (CHEBI:25697)