Vitas-M small molecule compound
4-{3-[(4-chlorophenyl)carbonyl]-4-hydroxy-1-[3-(morpholin-4-ium-4-yl)propyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}-2-ethoxyphenolate
Catalog ID
STL039705
SMILES CCOc1cc(ccc1[O-])C1N(CCC[NH+]2CCOCC2)C(=O)C(=C1C(=O)c1ccc(cc1)Cl)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 C26H29ClN2O6 MW 500.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29ClN2O6/c1-2-35-21-16-18(6-9-20(21)30)23-22(24(31)17-4-7-19(27)8-5-17)25(32)26(33)29(23)11-3-10-28-12-14-34-15-13-28/h4-9,16,23,30,32H,2-3,10-15H2,1H3InChIKey
NEQPICKOHHMDPB-UHFFFAOYSA-NSynonyms
4(3((4chlorophenyl)carbonyl)4hydroxy1(3(morpholin4ium4yl)propyl)5oxo25dihydro1Hpyrrol2yl)2ethoxyphenolate
CCOc1cc(ccc1(O))C1N(CCC(NH+)2CCOCC2)C(=O)C(=C1C(=O)c1ccc(cc1)Cl)O
MFCD03298653
ZINC000020100600
ZINC000020100603
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