Vitas-M small molecule compound
(E)-2,3-dihydro-1,4-benzodioxin-6-yl{2-(2,4-dimethoxyphenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK560046
SMILES COc1ccc(c(c1)OC)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+](C)C
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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 C25H28N2O7 MW 468.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O7/c1-26(2)9-10-27-22(17-7-6-16(31-3)14-19(17)32-4)21(24(29)25(27)30)23(28)15-5-8-18-20(13-15)34-12-11-33-18/h5-8,13-14,22,28H,9-12H2,1-4H3/b23-21+InChIKey
GUHJFBIPZBKNSR-XTQSDGFTSA-NSynonyms
618404-77-6(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)5(24dimethoxyphenyl)1(2(dimethylamino)ethyl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)5(24DIMETHOXYPHENYL)1(2DIMETHYLAMINOETHYL)PYRROLIDINE23DIONE
(E)23dihydro14benzodioxin6yl(2(24dimethoxyphenyl)1(2(dimethylammonio)ethyl)45dioxopyrrolidin3ylidene)methanolate
(E)23DIHYDRO14BENZODIOXIN6YL(2(24DIMETHOXYPHENYL)1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
4(2H3HBENZO(34E)14DIOXAN6YLCARBONYL)5(24DIMETHOXYPHENYL)1(2(DIMETHYLAMINO)ETHYL)3HYDROXY3PYRROLIN2ONE
618404776
CN(C)CCN1C(C(=C(C2=CC3=C(C=C2)OCCO3)O)C(=O)C1=O)C4=C(C=C(C=C4)OC)OC
COc1ccc(c(c1)OC)C1C(=C(c2ccc3c(c2)OCCO3)(O))C(=O)C(=O)N1CC(NH+)(C)C
InChI=1SC25H28N2O7c126(2)9102722(177616(313)1419(17)324)21(24(29)25(27)30)23(28)15581820(1315)3412113318h5813142228H912H214H3b2321+
MFCD18243436
ZINC000009311969
ZINC000009311970
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