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InChIKey | HWAQOZGATRIYQG-UHFFFAOYSA-L |
InChI | InChI=1S/C7H6O5S/c8-7(9)5-1-3-6(4-2-5)13(10,11)12/h1-4H,(H,8,9)(H,10,11,12)/p-2 |
SMILES | [O-]C(=O)c1ccc(cc1)S([O-])(=O)=O |
#reac | |
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Distinct reactions in my sandbox | 0 |
Distinct generic reactions in MNXref | 2 |
Distinct compatimentalized reactions in models | 0 |
Identifier | Description |
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metacycM:CPD-257 | 4-sulfobenzoate |
chebi:20476 | 4-sulfobenzoate (-)O3S-C6H4-COO(-) 4-sulfonatobenzoate 4-sulfonatobenzoate(2-) 4-sulphonatobenzoate |
chebi:16309 | 4-sulfobenzoate(1-) 4-sulfobenzoate 4-sulphobenzoate HO3S-C6H4-COO(-) |
envipath:...c573cd98c66f | 4-Sulfobenzoate |
chebi:30789 | 4-sulfobenzoic acid 4-Sulfobenzoic acid 4-sulphobenzoic acid HO3S-C6H4-COOH p-sulfobenzoic acid para-sulfobenzoic acid |
seedM:cpd01511 | 4-Sulfobenzoate 4-Sulfobenzoic acid 4-sulfobenzoate |
chebi:12045 chebi:1936 chebi:20477 keggC:M_C02236 seedM:M_cpd01511 | secondary/obsolete/fantasy identifier |
keggC:C02236 | 4-Sulfobenzoate 4-Sulfobenzoic acid |