Vitas-M small molecule compound
(E)-{1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Catalog ID
STK567246
SMILES C=CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+](CC)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 C28H32N2O6 MW 492.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2O6/c1-4-14-34-21-9-7-8-19(17-21)25-24(27(32)28(33)30(25)13-12-29(5-2)6-3)26(31)20-10-11-22-23(18-20)36-16-15-35-22/h4,7-11,17-18,25,31H,1,5-6,12-16H2,2-3H3/b26-24+InChIKey
DKZLFTNVACMLFN-SHHOIMCASA-NSynonyms
620561-15-1(4E)1(2(diethylamino)ethyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)5(3prop2enoxyphenyl)pyrrolidine23dione
(4E)1(2DIETHYLAMINOETHYL)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)5(3PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)45dioxo2(3(prop2en1yloxy)phenyl)pyrrolidin3ylidene)(23dihydro14benzodioxin6yl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXO2(3PROP2ENOXYPHENYL)PYRROLIDIN3YLIDENE)(23DIHYDRO14BENZODIOXIN6YL)METHANOLATE
620561151
C=CCOc1cccc(c1)C1C(=C(c2ccc3c(c2)OCCO3)(O))C(=O)C(=O)N1CC(NH+)(CC)CC
CCN(CC)CCN1C(C(=C(C2=CC3=C(C=C2)OCCO3)O)C(=O)C1=O)C4=CC(=CC=C4)OCC=C
InChI=1SC28H32N2O6c1414342197819(1721)2524(27(32)28(33)30(25)131229(52)63)26(31)2010112223(1820)3616153522h471117182531H1561216H223H3b2624+
MFCD18245144
ZINC000101313961
ZINC000101313964
Check stock
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