Vitas-M small molecule compound
(E)-{1-[2-(diethylammonio)ethyl]-2-(3,4-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[4-(prop-2-en-1-yloxy)phenyl]methanolate
Catalog ID
STL042760
SMILES C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)OC)OC)CC[NH+](CC)CC)/[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 C28H34N2O6 MW 494.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2O6/c1-6-17-36-21-12-9-19(10-13-21)26(31)24-25(20-11-14-22(34-4)23(18-20)35-5)30(28(33)27(24)32)16-15-29(7-2)8-3/h6,9-14,18,25,31H,1,7-8,15-17H2,2-5H3/b26-24+InChIKey
SEOKYKINXWHSQU-SHHOIMCASA-NSynonyms
848734-59-8(4E)1(2DIETHYLAMINOETHYL)5(34DIMETHOXYPHENYL)4(HYDROXY(4PROP2ENOXYPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)2(34dimethoxyphenyl)45dioxopyrrolidin3ylidene)(4(prop2en1yloxy)phenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)2(34DIMETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4PROP2ENOXYPHENYL)METHANOLATE
848734598
C=CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(c(c1)OC)OC)CC(NH+)(CC)CC)(O)
CC(NH+)(CC)CCN1C(C(=C(C2=CC=C(C=C2)OCC=C)(O))C(=O)C1=O)C3=CC(=C(C=C3)OC)OC
InChI=1SC28H34N2O6c1617362112919(101321)26(31)2425(20111422(344)23(1820)355)30(28(33)27(24)32)161529(72)83h6914182531H1781517H225H3b2624+
MFCD18248180
ZINC000101287139
ZINC000101287144
Check stock
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Check stock on Vitas-MAvailable files
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