Vitas-M small molecule compound
(E)-{1-[2-(diethylammonio)ethyl]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Catalog ID
STK567711
SMILES CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/[O-])/C1c1ccc(cc1)OC)CC
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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 C26H30N2O6 MW 466.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O6/c1-4-27(5-2)12-13-28-23(17-6-9-19(32-3)10-7-17)22(25(30)26(28)31)24(29)18-8-11-20-21(16-18)34-15-14-33-20/h6-11,16,23,29H,4-5,12-15H2,1-3H3/b24-22+InChIKey
WTJJLKFOUXXJCM-ZNTNEXAZSA-NSynonyms
(4E)1(2DIETHYLAMINOETHYL)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)5(4METHOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)2(4methoxyphenyl)45dioxopyrrolidin3ylidene)(23dihydro14benzodioxin6yl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)2(4METHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(23DIHYDRO14BENZODIOXIN6YL)METHANOLATE
CC(NH+)(CC)CCN1C(C(=C(C2=CC3=C(C=C2)OCCO3)(O))C(=O)C1=O)C4=CC=C(C=C4)OC
CC(NH+)(CCN1C(=O)C(=O)C(=C(c2ccc3c(c2)OCCO3)(O))C1c1ccc(cc1)OC)CC
InChI=1SC26H30N2O6c1427(52)12132823(176919(323)10717)22(25(30)26(28)31)24(29)188112021(1618)3415143320h611162329H451215H213H3b2422+
MFCD18245173
ZINC000102651952
ZINC000102651955
Check stock
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Check stock on Vitas-MAvailable files
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