Vitas-M small molecule compound
4-{3-acetyl-4-hydroxy-1-[3-(morpholin-4-ium-4-yl)propyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}phenolate
Catalog ID
STL147838
SMILES [O-]c1ccc(cc1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=C1C(=O)C)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 C19H24N2O5 MW 360.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N2O5/c1-13(22)16-17(14-3-5-15(23)6-4-14)21(19(25)18(16)24)8-2-7-20-9-11-26-12-10-20/h3-6,17,23-24H,2,7-12H2,1H3InChIKey
XJGJZORGWWRMHN-UHFFFAOYSA-NSynonyms
440096-53-7(O)c1ccc(cc1)C1N(CCC(NH+)2CCOCC2)C(=O)C(=C1C(=O)C)O
3ACETYL4HYDROXY2(4HYDROXYPHENYL)1(3MORPHOLIN4YLPROPYL)2HPYRROL5ONE
4(3acetyl4hydroxy1(3(morpholin4ium4yl)propyl)5oxo25dihydro1Hpyrrol2yl)phenolate
4(3ACETYL4HYDROXY1(3MORPHOLIN4IUM4YLPROPYL)5OXO2HPYRROL2YL)PHENOLATE
440096537
CC(=O)C1=C(C(=O)N(C1C2=CC=C(C=C2)(O))CCC(NH+)3CCOCC3)O
InChI=1SC19H24N2O5c113(22)1617(143515(23)6414)21(19(25)18(16)24)8272091126121020h36172324H2712H21H3
MFCD02231527
ZINC000000870908
ZINC000000870909
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