Vitas-M small molecule compound
5-[4-{(E)-[2-hydroxy-5-(methoxycarbonyl)phenyl]diazenyl}-3-(octadecanoylamino)-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]-2-phenoxybenzenesulfonic acid
Catalog ID
STK396296
SMILES CCCCCCCCCCCCCCCCCC(=O)NC1=NN(C(=O)C1/N=N/c1cc(ccc1O)C(=O)OC)c1ccc(c(c1)S(=O)(=O)O)Oc1ccccc1
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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 C41H53N5O9S MW 791.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C41H53N5O9S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-37(48)42-39-38(44-43-33-28-30(41(50)54-2)24-26-34(33)47)40(49)46(45-39)31-25-27-35(36(29-31)56(51,52)53)55-32-21-18-17-19-22-32/h17-19,21-22,24-29,38,47H,3-16,20,23H2,1-2H3,(H,42,45,48)(H,51InChIKey
PGWVCCWZVGUCTL-VGFSZAGXSA-NSynonyms
5(4((E)(2hydroxy5(methoxycarbonyl)phenyl)diazenyl)3(octadecanoylamino)5oxo45dihydro1Hpyrazol1yl)2phenoxybenzenesulfonicacid
CCCCCCCCCCCCCCCCCC(=O)NC1=NN(C(=O)C1N=Nc1cc(ccc1O)C(=O)OC)c1ccc(c(c1)S(=O)(=O)O)Oc1ccccc1
MFCD00302637
ZINC000097965580
ZINC000150386767
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