Vitas-M small molecule compound
(E)-(3,4-dimethoxyphenyl){1-[2-(dimethylammonio)ethyl]-2-(furan-2-yl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL147919
SMILES COc1cc(ccc1OC)/C(=C/1\C(=O)C(=O)N(C1c1ccco1)CC[NH+](C)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 C21H24N2O6 MW 400.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O6/c1-22(2)9-10-23-18(15-6-5-11-29-15)17(20(25)21(23)26)19(24)13-7-8-14(27-3)16(12-13)28-4/h5-8,11-12,18,24H,9-10H2,1-4H3/b19-17+InChIKey
ALJDVWXNULXVRM-HTXNQAPBSA-NSynonyms
845647-97-4(4E)4((34DIMETHOXYPHENYL)HYDROXYMETHYLIDENE)1(2DIMETHYLAMINOETHYL)5(FURAN2YL)PYRROLIDINE23DIONE
(E)(34dimethoxyphenyl)(1(2(dimethylammonio)ethyl)2(furan2yl)45dioxopyrrolidin3ylidene)methanolate
(E)(34DIMETHOXYPHENYL)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(FURAN2YL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
4((34DIMETHOXYPHENYL)CARBONYL)1(2(DIMETHYLAMINO)ETHYL)5(2FURYL)3HYDROXY3PYRROLIN2ONE
845647974
C(NH+)(C)CCN1C(C(=C(C2=CC(=C(C=C2)OC)OC)(O))C(=O)C1=O)C3=CC=CO3
COc1cc(ccc1OC)C(=C1C(=O)C(=O)N(C1c1ccco1)CC(NH+)(C)C)(O)
InChI=1SC21H24N2O6c122(2)9102318(1565112915)17(20(25)21(23)26)19(24)137814(273)16(1213)284h5811121824H910H214H3b1917+
MFCD20755290
ZINC000006294699
ZINC000006294702
Check stock
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Check stock on Vitas-MAvailable files
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