Vitas-M small molecule compound
(E)-(4-butoxyphenyl){2-(4-hydroxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL055273
SMILES CCCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)CC[NH+]1CCOCC1)/[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 C27H32N2O6 MW 480.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O6/c1-2-3-16-35-22-10-6-20(7-11-22)25(31)23-24(19-4-8-21(30)9-5-19)29(27(33)26(23)32)13-12-28-14-17-34-18-15-28/h4-11,24,30-31H,2-3,12-18H2,1H3/b25-23+InChIKey
BFPNZWABHKWKRX-WJTDDFOZSA-NSynonyms
(4E)4((4BUTOXYPHENYL)HYDROXYMETHYLIDENE)5(4HYDROXYPHENYL)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(4butoxyphenyl)(2(4hydroxyphenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)methanolate
(E)(4BUTOXYPHENYL)(2(4HYDROXYPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
CCCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC(NH+)3CCOCC3)C4=CC=C(C=C4)O)(O)
CCCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)O)CC(NH+)1CCOCC1)(O)
InChI=1SC27H32N2O6c12316352210620(71122)25(31)2324(194821(30)9519)29(27(33)26(23)32)131228141734181528h411243031H231218H21H3b2523+
MFCD18249667
ZINC000102894287
ZINC000102894291
Check stock
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