Vitas-M small molecule compound
5,5'-[{5-[(2,2-dimethylpropanoyl)amino]benzene-1,3-diyl}bis(carbonylimino)]dibenzene-1,3-dicarboxylic acid
Catalog ID
STK296036
SMILES O=C(C(C)(C)C)Nc1cc(cc(c1)C(=O)Nc1cc(cc(c1)C(=O)O)C(=O)O)C(=O)Nc1cc(cc(c1)C(=O)O)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 C29H25N3O11 MW 591.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O11/c1-29(2,3)28(43)32-21-7-13(22(33)30-19-9-15(24(35)36)5-16(10-19)25(37)38)4-14(8-21)23(34)31-20-11-17(26(39)40)6-18(12-20)27(41)42/h4-12H,1-3H3,(H,30,33)(H,31,34)(H,32,43)(H,35,36)(H,37,38)(H,39,40)(H,41,42)InChIKey
GVGYQFMCTGGDRW-UHFFFAOYSA-NSynonyms
5((3((35DICARBOXYPHENYL)CARBAMOYL)5(22DIMETHYLPROPANOYLAMINO)BENZOYL)AMINO)BENZENE13DICARBOXYLICACID
55((5((22dimethylpropanoyl)amino)benzene13diyl)bis(carbonylimino))dibenzene13dicarboxylicacid
CC(C)(C)C(=O)NC1=CC(=CC(=C1)C(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O)C(=O)NC3=CC(=CC(=C3)C(=O)O)C(=O)O
InChI=1SC29H25N3O11c129(23)28(43)3221713(22(33)3019915(24(35)36)516(1019)25(37)38)414(821)23(34)31201117(26(39)40)618(1220)27(41)42h412H13H3(H3033)(H3134)(H3243)(H3536)(H3738)(H3940)(H4142)
MFCD01005943
ZINC000059857964
ZINC59857964
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