Vitas-M small molecule compound
(E)-{1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(4-propoxyphenyl)pyrrolidin-3-ylidene}[4-(prop-2-en-1-yloxy)phenyl]methanolate
Catalog ID
STL037745
SMILES CCCOc1ccc(cc1)C1N(CC[NH+]2CCOCC2)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 C29H34N2O6 MW 506.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O6/c1-3-17-36-23-9-5-21(6-10-23)26-25(27(32)22-7-11-24(12-8-22)37-18-4-2)28(33)29(34)31(26)14-13-30-15-19-35-20-16-30/h4-12,26,32H,2-3,13-20H2,1H3/b27-25+InChIKey
HYZBRAPWXKVFJB-IMVLJIQESA-NSynonyms
636992-10-4(4E)4(HYDROXY(4PROP2ENOXYPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)5(4PROPOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(2(morpholin4ium4yl)ethyl)45dioxo2(4propoxyphenyl)pyrrolidin3ylidene)(4(prop2en1yloxy)phenyl)methanolate
(E)(1(2MORPHOLIN4IUM4YLETHYL)45DIOXO2(4PROPOXYPHENYL)PYRROLIDIN3YLIDENE)(4PROP2ENOXYPHENYL)METHANOLATE
3HYDROXY1(2MORPHOLIN4YLETHYL)4((4PROP2ENYLOXYPHENYL)CARBONYL)5(4PROPOXYPHENYL)3PYRROLIN2ONE
636992104
CCCOC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)OCC=C)O)C(=O)C(=O)N2CCN4CCOCC4
CCCOc1ccc(cc1)C1N(CC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1ccc(cc1)OCC=C)(O)
InChI=1SC29H34N2O6c131736239521(61023)2625(27(32)2271124(12822)371842)28(33)29(34)31(26)141330151935201630h4122632H231320H21H3b2725+
MFCD18247478
ZINC000102859734
ZINC000102859738
Check stock
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Check stock on Vitas-MAvailable files
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