Vitas-M small molecule compound
(E)-{2-(4-ethoxy-3-methoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(4-ethoxyphenyl)methanolate
Catalog ID
STL147792
SMILES CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)OC)OCC)CC[NH+]1CCOCC1)/[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 C28H34N2O7 MW 510.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2O7/c1-4-36-21-9-6-19(7-10-21)26(31)24-25(20-8-11-22(37-5-2)23(18-20)34-3)30(28(33)27(24)32)13-12-29-14-16-35-17-15-29/h6-11,18,25,31H,4-5,12-17H2,1-3H3/b26-24+InChIKey
SFQBNGIKVRHNMZ-SHHOIMCASA-NSynonyms
636990-48-2(4E)5(4ETHOXY3METHOXYPHENYL)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(2(4ethoxy3methoxyphenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)(4ethoxyphenyl)methanolate
(E)(2(4ETHOXY3METHOXYPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)(4ETHOXYPHENYL)METHANOLATE
5(4ETHOXY3METHOXYPHENYL)4((4ETHOXYPHENYL)CARBONYL)3HYDROXY1(2MORPHOLIN4YLETHYL)3PYRROLIN2ONE
636990482
CCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC(NH+)3CCOCC3)C4=CC(=C(C=C4)OCC)OC)(O)
CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(c(c1)OC)OCC)CC(NH+)1CCOCC1)(O)
InChI=1SC28H34N2O7c1436219619(71021)26(31)2425(2081122(3752)23(1820)343)30(28(33)27(24)32)131229141635171529h611182531H451217H213H3b2624+
MFCD20755259
ZINC000102925236
ZINC000102925239
Check stock
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Check stock on Vitas-MAvailable files
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