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}-2-methoxyphenolate
Catalog ID
STL039090
SMILES COc1cc(ccc1[O-])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 C20H26N2O6 MW 390.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2O6/c1-13(23)17-18(14-4-5-15(24)16(12-14)27-2)22(20(26)19(17)25)7-3-6-21-8-10-28-11-9-21/h4-5,12,18,24-25H,3,6-11H2,1-2H3InChIKey
SQGCZGRKPBUETE-UHFFFAOYSA-NSynonyms
440096-50-43ACETYL4HYDROXY2(4HYDROXY3METHOXYPHENYL)1(3MORPHOLIN4YLPROPYL)2HPYRROL5ONE
4(3acetyl4hydroxy1(3(morpholin4ium4yl)propyl)5oxo25dihydro1Hpyrrol2yl)2methoxyphenolate
4(3ACETYL4HYDROXY1(3MORPHOLIN4IUM4YLPROPYL)5OXO2HPYRROL2YL)2METHOXYPHENOLATE
440096504
4ACETYL3HYDROXY5(4HYDROXY3METHOXYPHENYL)1(3(4MORPHOLINYL)PROPYL)15DIHYDRO2HPYRROL2ONE
CC(=O)C1=C(C(=O)N(C1C2=CC(=C(C=C2)O)OC)CCCN3CCOCC3)O
COc1cc(ccc1(O))C1N(CCC(NH+)2CCOCC2)C(=O)C(=C1C(=O)C)O
InChI=1SC20H26N2O6c113(23)1718(144515(24)16(1214)272)22(20(26)19(17)25)736218102811921h4512182425H3611H212H3
MFCD02231524
ZINC000017918674
ZINC000019904621
Check stock
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Check stock on Vitas-MAvailable files
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