Vitas-M small molecule compound
(E)-{2-(4-methoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate
Catalog ID
STL045572
SMILES CCCOc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)OC)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 C28H34N2O6 MW 494.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2O6/c1-3-17-36-23-11-7-21(8-12-23)26(31)24-25(20-5-9-22(34-2)10-6-20)30(28(33)27(24)32)14-4-13-29-15-18-35-19-16-29/h5-12,25,31H,3-4,13-19H2,1-2H3/b26-24+InChIKey
ZRDTZFIOSJWMAH-SHHOIMCASA-NSynonyms
615272-50-9(4E)4(HYDROXY(4PROPOXYPHENYL)METHYLIDENE)5(4METHOXYPHENYL)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(4methoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(4propoxyphenyl)methanolate
(E)(2(4METHOXYPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(4PROPOXYPHENYL)METHANOLATE
3HYDROXY5(4METHOXYPHENYL)1(3MORPHOLIN4YLPROPYL)4((4PROPOXYPHENYL)CARBONYL)3PYRROLIN2ONE
615272509
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC=C(C=C4)OC)O
CCCOc1ccc(cc1)C(=C1C(c2ccc(cc2)OC)N(C(=O)C1=O)CCC(NH+)1CCOCC1)(O)
InChI=1SC28H34N2O6c1317362311721(81223)26(31)2425(205922(342)10620)30(28(33)27(24)32)1441329151835191629h5122531H341319H212H3b2624+
MFCD18248663
ZINC000102878325
ZINC000102878328
Check stock
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Check stock on Vitas-MAvailable files
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