Vitas-M small molecule compound
4-{[(2E)-3-carboxyprop-2-enoyl]amino}benzenesulfonate
Catalog ID
STL195308
SMILES O=C(Nc1ccc(cc1)S(=O)(=O)[O-])/C=C/C(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C10H8NO6S MW 270.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9NO6S/c12-9(5-6-10(13)14)11-7-1-3-8(4-2-7)18(15,16)17/h1-6H,(H,11,12)(H,13,14)(H,15,16,17)/p-1/b6-5+InChIKey
KZXUCEDDWWVYLD-AATRIKPKSA-MSynonyms
2088951-29-32088951293
4(((2E)3carboxyprop2enoyl)amino)benzenesulfonate
4(((E)3carboxyprop2enoyl)amino)benzenesulfonate
C1=CC(=CC=C1NC(=O)C=CC(=O)O)S(=O)(=O)(O)
InChI=1SC10H9NO6Sc129(5610(13)14)117138(427)18(1516)17h16H(H1112)(H1314)(H151617)p1b65+
MFCD00507579
O=C(Nc1ccc(cc1)S(=O)(=O)(O))C=CC(=O)O
ZINC000034190910
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