Vitas-M small molecule compound
(E)-{2-(3,4-dimethoxyphenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}[4-(2-methylpropoxy)phenyl]methanolate
Catalog ID
STL050352
SMILES COc1cc(ccc1OC)C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCC(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 C28H36N2O6 MW 496.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N2O6/c1-18(2)17-36-21-11-8-19(9-12-21)26(31)24-25(20-10-13-22(34-5)23(16-20)35-6)30(28(33)27(24)32)15-7-14-29(3)4/h8-13,16,18,25,31H,7,14-15,17H2,1-6H3/b26-24+InChIKey
SXVDPBJOOHNGFN-SHHOIMCASA-NSynonyms
848673-43-8(4E)5(34DIMETHOXYPHENYL)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(4(2METHYLPROPOXY)PHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(34dimethoxyphenyl)1(3(dimethylammonio)propyl)45dioxopyrrolidin3ylidene)(4(2methylpropoxy)phenyl)methanolate
(E)(2(34DIMETHOXYPHENYL)1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXOPYRROLIDIN3YLIDENE)(4(2METHYLPROPOXY)PHENYL)METHANOLATE
848673438
CC(C)COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN(C)C)C3=CC(=C(C=C3)OC)OC)O
COc1cc(ccc1OC)C1N(CCC(NH+)(C)C)C(=O)C(=O)C1=C(c1ccc(cc1)OCC(C)C)(O)
InChI=1SC28H36N2O6c118(2)17362111819(91221)26(31)2425(20101322(345)23(1620)356)30(28(33)27(24)32)1571429(3)4h81316182531H7141517H216H3b2624+
MFCD18249327
ZINC000102886272
ZINC000102886274
Check stock
See real-time availability and sample size for STL050352 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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