Vitas-M small molecule compound
(E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-[3-(pentyloxy)phenyl]pyrrolidin-3-ylidene}methanolate
Catalog ID
STK587377
SMILES CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+](C)C
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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/c1-4-5-6-14-34-21-9-7-8-19(17-21)25-24(27(32)28(33)30(25)13-12-29(2)3)26(31)20-10-11-22-23(18-20)36-16-15-35-22/h7-11,17-18,25,31H,4-6,12-16H2,1-3H3/b26-24+InChIKey
HWWQTJPKLFANAU-SHHOIMCASA-NSynonyms
620559-57-1(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(2(dimethylamino)ethyl)5(3pentoxyphenyl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(2DIMETHYLAMINOETHYL)5(3PENTOXYPHENYL)PYRROLIDINE23DIONE
(E)23dihydro14benzodioxin6yl(1(2(dimethylammonio)ethyl)45dioxo2(3(pentyloxy)phenyl)pyrrolidin3ylidene)methanolate
620559571
CCCCCOC1=CC=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCN(C)C
CCCCCOc1cccc(c1)C1C(=C(c2ccc3c(c2)OCCO3)(O))C(=O)C(=O)N1CC(NH+)(C)C
InChI=1SC28H34N2O6c145614342197819(1721)2524(27(32)28(33)30(25)131229(2)3)26(31)2010112223(1820)3616153522h71117182531H461216H213H3b2624+
MFCD07210956
ZINC000102601419
ZINC000102601424
Check stock
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