Vitas-M small molecule compound
4-{3-(furan-2-ylcarbonyl)-4-hydroxy-1-[3-(morpholin-4-ium-4-yl)propyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}phenolate
Catalog ID
STK561900
SMILES [O-]c1ccc(cc1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=C1C(=O)c1ccco1)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 C22H24N2O6 MW 412.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O6/c25-16-6-4-15(5-7-16)19-18(20(26)17-3-1-12-30-17)21(27)22(28)24(19)9-2-8-23-10-13-29-14-11-23/h1,3-7,12,19,25,27H,2,8-11,13-14H2InChIKey
RIGUPDWDEJNTGJ-UHFFFAOYSA-NSynonyms
496772-31-7(O)c1ccc(cc1)C1N(CCC(NH+)2CCOCC2)C(=O)C(=C1C(=O)c1ccco1)O
3(FURAN2CARBONYL)4HYDROXY2(4HYDROXYPHENYL)1(3MORPHOLIN4YLPROPYL)2HPYRROL5ONE
4(3(FURAN2CARBONYL)4HYDROXY1(3MORPHOLIN4IUM4YLPROPYL)5OXO2HPYRROL2YL)PHENOLATE
4(3(furan2ylcarbonyl)4hydroxy1(3(morpholin4ium4yl)propyl)5oxo25dihydro1Hpyrrol2yl)phenolate
496772317
C1COCC(NH+)1CCCN2C(C(=C(C2=O)O)C(=O)C3=CC=CO3)C4=CC=C(C=C4)(O)
InChI=1SC22H24N2O6c25166415(5716)1918(20(26)1731123017)21(27)22(28)24(19)92823101329141123h13712192527H28111314H2
MFCD03298482
ZINC000013161722
ZINC000018204046
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