Vitas-M small molecule compound
2-ethoxy-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
STK561269
SMILES CCOc1cc(ccc1[O-])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 C24H28N2O7 MW 456.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O7/c1-2-32-19-15-16(6-7-17(19)27)21-20(22(28)18-5-3-12-33-18)23(29)24(30)26(21)9-4-8-25-10-13-31-14-11-25/h3,5-7,12,15,21,27,29H,2,4,8-11,13-14H2,1H3InChIKey
CFIHXDSYFJYCSJ-UHFFFAOYSA-NSynonyms
497865-85-72(3ETHOXY4HYDROXYPHENYL)3(FURAN2CARBONYL)4HYDROXY1(3MORPHOLIN4YLPROPYL)2HPYRROL5ONE
2ETHOXY4(3(FURAN2CARBONYL)4HYDROXY1(3MORPHOLIN4IUM4YLPROPYL)5OXO2HPYRROL2YL)PHENOLATE
2ethoxy4(3(furan2ylcarbonyl)4hydroxy1(3(morpholin4ium4yl)propyl)5oxo25dihydro1Hpyrrol2yl)phenolate
497865857
CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2CCC(NH+)3CCOCC3)O)C(=O)C4=CC=CO4)(O)
CCOc1cc(ccc1(O))C1N(CCC(NH+)2CCOCC2)C(=O)C(=C1C(=O)c1ccco1)O
InChI=1SC24H28N2O7c1232191516(6717(19)27)2120(22(28)1853123318)23(29)24(30)26(21)94825101331141125h3571215212729H248111314H21H3
MFCD03300945
ZINC000020102198
ZINC000020102202
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