Vitas-M small molecule compound
(E)-{2-(4-ethoxy-3-methoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}[3-methyl-4-(propan-2-yloxy)phenyl]methanolate
Catalog ID
STK564178
SMILES CCOc1ccc(cc1OC)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)C)OC(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 C31H40N2O7 MW 552.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H40N2O7/c1-6-39-25-11-8-22(19-26(25)37-5)28-27(29(34)23-9-10-24(21(4)18-23)40-20(2)3)30(35)31(36)33(28)13-7-12-32-14-16-38-17-15-32/h8-11,18-20,28,34H,6-7,12-17H2,1-5H3/b29-27+InChIKey
ZSLZIGNHUXZOOB-ORIPQNMZSA-NSynonyms
(4E)5(4ETHOXY3METHOXYPHENYL)4(HYDROXY(3METHYL4PROPAN2YLOXYPHENYL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(4ethoxy3methoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(3methyl4(propan2yloxy)phenyl)methanolate
(E)(2(4ETHOXY3METHOXYPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(3METHYL4PROPAN2YLOXYPHENYL)METHANOLATE
5(4ETHOXY3METHOXYPHENYL)3HYDROXY4(4ISOPROPOXY3METHYLBENZOYL)1(3MORPHOLINOPROPYL)1HPYRROL2(5H)ONE
CCOC1=C(C=C(C=C1)C2C(=C(C3=CC(=C(C=C3)OC(C)C)C)(O))C(=O)C(=O)N2CCC(NH+)4CCOCC4)OC
CCOc1ccc(cc1OC)C1N(CCC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1ccc(c(c1)C)OC(C)C)(O)
InChI=1SC31H40N2O7c16392511822(1926(25)375)2827(29(34)2391024(21(4)1823)4020(2)3)30(35)31(36)33(28)1371232141638171532h81118202834H671217H215H3b2927+
MFCD18244481
ZINC000102526302
ZINC000102526309
Check stock
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