Vitas-M small molecule compound
(E)-{1-[3-(dimethylammonio)propyl]-2-(5-methylfuran-2-yl)-4,5-dioxopyrrolidin-3-ylidene}(3-methoxyphenyl)methanolate
Catalog ID
STK563989
SMILES COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(o1)C)CCC[NH+](C)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 C22H26N2O5 MW 398.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O5/c1-14-9-10-17(29-14)19-18(20(25)15-7-5-8-16(13-15)28-4)21(26)22(27)24(19)12-6-11-23(2)3/h5,7-10,13,19,25H,6,11-12H2,1-4H3/b20-18+InChIKey
QESJJQVOHZNTAP-CZIZESTLSA-NSynonyms
608498-32-4(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)5(5METHYLFURAN2YL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)2(5methylfuran2yl)45dioxopyrrolidin3ylidene)(3methoxyphenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(5METHYLFURAN2YL)45DIOXOPYRROLIDIN3YLIDENE)(3METHOXYPHENYL)METHANOLATE
608498324
CC1=CC=C(O1)C2C(=C(C3=CC(=CC=C3)OC)O)C(=O)C(=O)N2CCCN(C)C
COc1cccc(c1)C(=C1C(=O)C(=O)N(C1c1ccc(o1)C)CCC(NH+)(C)C)(O)
InChI=1SC22H26N2O5c11491017(2914)1918(20(25)1575816(1315)284)21(26)22(27)24(19)1261123(2)3h5710131925H61112H214H3b2018+
MFCD18244434
ZINC000005409134
ZINC000005409139
Check stock
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Check stock on Vitas-MAvailable files
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