Vitas-M small molecule compound

4-({3-[(1E)-1-{2-[(3,5-dihydroxyphenyl)carbonyl]hydrazinylidene}ethyl]phenyl}amino)-4-oxobutanoic acid

Catalog ID
STK481404
SMILES OC(=O)CCC(=O)Nc1cccc(c1)/C(=N/NC(=O)c1cc(O)cc(c1)O)/C

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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 C19H19N3O6 MW 385.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O6/c1-11(21-22-19(28)13-8-15(23)10-16(24)9-13)12-3-2-4-14(7-12)20-17(25)5-6-18(26)27/h2-4,7-10,23-24H,5-6H2,1H3,(H,20,25)(H,22,28)(H,26,27)/b21-11+
InChIKey
ACMFVJWKPLUSNZ-SRZZPIQSSA-N
Synonyms

3(N(3((1E)2((35DIHYDROXYPHENYL)CARBONYLAMINO)1METHYL2AZAVINYL)PHENYL)CARBAMOYL)PROPANOICACID
4((3((1E)1(2((35dihydroxyphenyl)carbonyl)hydrazinylidene)ethyl)phenyl)amino)4oxobutanoicacid
4(3((E)N((35dihydroxybenzoyl)amino)Cmethylcarbonimidoyl)anilino)4oxobutanoicacid
CC(=NNC(=O)C1=CC(=CC(=C1)O)O)C2=CC(=CC=C2)NC(=O)CCC(=O)O
InChI=1SC19H19N3O6c111(212219(28)13815(23)1016(24)913)1232414(712)2017(25)5618(26)27h247102324H56H21H3(H2025)(H2228)(H2627)b2111+
MFCD08569681
OC(=O)CCC(=O)Nc1cccc(c1)C(=NNC(=O)c1cc(O)cc(c1)O)C
ZINC000013321939
ZINC59600948

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Available files

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