Vitas-M small molecule compound
(E)-{1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-(4-propoxyphenyl)pyrrolidin-3-ylidene}[4-(prop-2-en-1-yloxy)phenyl]methanolate
Catalog ID
STL045859
SMILES CCCOc1ccc(cc1)C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCC=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 C28H34N2O5 MW 478.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2O5/c1-5-18-34-22-12-8-20(9-13-22)25-24(27(32)28(33)30(25)17-7-16-29(3)4)26(31)21-10-14-23(15-11-21)35-19-6-2/h6,8-15,25,31H,2,5,7,16-19H2,1,3-4H3/b26-24+InChIKey
OUAGWBJICIZZDA-SHHOIMCASA-NSynonyms
573943-00-7(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(4PROP2ENOXYPHENYL)METHYLIDENE)5(4PROPOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)45dioxo2(4propoxyphenyl)pyrrolidin3ylidene)(4(prop2en1yloxy)phenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXO2(4PROPOXYPHENYL)PYRROLIDIN3YLIDENE)(4PROP2ENOXYPHENYL)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)3HYDROXY4((4PROP2ENYLOXYPHENYL)CARBONYL)5(4PROPOXYPHENYL)3PYRROLIN2ONE
573943007
CCCOC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)OCC=C)(O))C(=O)C(=O)N2CCC(NH+)(C)C
CCCOc1ccc(cc1)C1N(CCC(NH+)(C)C)C(=O)C(=O)C1=C(c1ccc(cc1)OCC=C)(O)
InChI=1SC28H34N2O5c1518342212820(91322)2524(27(32)28(33)30(25)1771629(3)4)26(31)21101423(151121)351962h68152531H2571619H2134H3b2624+
MFCD18248730
ZINC000009339616
ZINC000009339617
Check stock
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