Vitas-M small molecule compound

3,3'-methanediylbis{6-[(3-carboxypropanoyl)amino]benzoic acid}

Catalog ID
STK094471
SMILES O=C(Nc1ccc(cc1C(=O)O)Cc1ccc(c(c1)C(=O)O)NC(=O)CCC(=O)O)CCC(=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 C23H22N2O10 MW 486.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O10/c26-18(5-7-20(28)29)24-16-3-1-12(10-14(16)22(32)33)9-13-2-4-17(15(11-13)23(34)35)25-19(27)6-8-21(30)31/h1-4,10-11H,5-9H2,(H,24,26)(H,25,27)(H,28,29)(H,30,31)(H,32,33)(H,34,35)
InChIKey
YQZCZXSIGIGLHJ-UHFFFAOYSA-N
Synonyms
351893-66-8
33METHANEDIYLBIS(6((3CARBOXYPROPANOYL)AMINO)BENZOICACID)
351893668
5((3CARBOXY4((4HYDROXY4OXOBUTANOYL)AMINO)PHENYL)METHYL)2((4HYDROXY4OXOBUTANOYL)AMINO)BENZOICACID
5((3CARBOXY4(3CARBOXYPROPANOYLAMINO)PHENYL)METHYL)2(3CARBOXYPROPANOYLAMINO)BENZOICACID
C1=CC(=C(C=C1CC2=CC(=C(C=C2)NC(=O)CCC(=O)O)C(=O)O)C(=O)O)NC(=O)CCC(=O)O
InChI=1SC23H22N2O10c2618(5720(28)29)24163112(1014(16)22(32)33)9132417(15(1113)23(34)35)2519(27)6821(30)31h141011H59H2(H2426)(H2527)(H2829)(H3031)(H3233)(H3435)
MFCD00316896
O=C(Nc1ccc(cc1C(=O)O)Cc1ccc(c(c1)C(=O)O)NC(=O)CCC(=O)O)CCC(=O)O
STK094471
ZINC000013549545
ZINC13549545

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.