Vitas-M small molecule compound
(E)-{2-(furan-2-yl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(4-methylphenyl)methanolate
Catalog ID
STL150462
SMILES Cc1ccc(cc1)/C(=C\1/C(c2ccco2)N(C(=O)C1=O)CCC[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 C23H26N2O5 MW 410.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O5/c1-16-5-7-17(8-6-16)21(26)19-20(18-4-2-13-30-18)25(23(28)22(19)27)10-3-9-24-11-14-29-15-12-24/h2,4-8,13,20,26H,3,9-12,14-15H2,1H3/b21-19+InChIKey
BYIVMVDEOXIBIQ-XUTLUUPISA-NSynonyms
(4E)5(FURAN2YL)4(HYDROXY(4METHYLPHENYL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(furan2yl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(4methylphenyl)methanolate
(E)(2(FURAN2YL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHYLPHENYL)METHANOLATE
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC=CO4)O
Cc1ccc(cc1)C(=C1C(c2ccco2)N(C(=O)C1=O)CCC(NH+)1CCOCC1)(O)
InChI=1SC23H26N2O5c1165717(8616)21(26)1920(1842133018)25(23(28)22(19)27)103924111429151224h248132026H39121415H21H3b2119+
MFCD20755836
ZINC000102930751
ZINC000102930754
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