Vitas-M small molecule compound
(E)-(4-butoxy-3-methylphenyl){1-[2-(dimethylammonio)ethyl]-2-(4-hydroxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL037014
SMILES CCCCOc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)CC[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 C26H32N2O5 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N2O5/c1-5-6-15-33-21-12-9-19(16-17(21)2)24(30)22-23(18-7-10-20(29)11-8-18)28(14-13-27(3)4)26(32)25(22)31/h7-12,16,23,29-30H,5-6,13-15H2,1-4H3/b24-22+InChIKey
OBMZGXRCIQAZBE-ZNTNEXAZSA-NSynonyms
(4E)4((4butoxy3methylphenyl)hydroxymethylidene)1(2(dimethylamino)ethyl)5(4hydroxyphenyl)pyrrolidine23dione
(4E)4((4BUTOXY3METHYLPHENYL)HYDROXYMETHYLIDENE)1(2DIMETHYLAMINOETHYL)5(4HYDROXYPHENYL)PYRROLIDINE23DIONE
(E)(4butoxy3methylphenyl)(1(2(dimethylammonio)ethyl)2(4hydroxyphenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(4BUTOXY3METHYLPHENYL)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(4HYDROXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
CCCCOC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN(C)C)C3=CC=C(C=C3)O)O)C
CCCCOc1ccc(cc1C)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)O)CC(NH+)(C)C)(O)
InChI=1SC26H32N2O5c15615332112919(1617(21)2)24(30)2223(1871020(29)11818)28(141327(3)4)26(32)25(22)31h71216232930H561315H214H3b2422+
MFCD18247339
ZINC000102857336
ZINC000102857339
Check stock
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Check stock on Vitas-MAvailable files
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