Vitas-M small molecule compound
(E)-2,3-dihydro-1,4-benzodioxin-6-yl{2-[3-ethoxy-4-(pentyloxy)phenyl]-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK569279
SMILES CCCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1
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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 C32H40N2O8 MW 580.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H40N2O8/c1-3-5-6-15-40-24-9-7-22(20-26(24)39-4-2)29-28(30(35)23-8-10-25-27(21-23)42-19-18-41-25)31(36)32(37)34(29)12-11-33-13-16-38-17-14-33/h7-10,20-21,29,35H,3-6,11-19H2,1-2H3/b30-28+InChIKey
FWWWINPYVICHIR-SJCQXOIGSA-NSynonyms
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)5(3ETHOXY4PENTOXYPHENYL)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)23dihydro14benzodioxin6yl(2(3ethoxy4(pentyloxy)phenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)methanolate
(E)23DIHYDRO14BENZODIOXIN6YL(2(3ETHOXY4PENTOXYPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
CCCCCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)(O))C(=O)C(=O)N2CC(NH+)5CCOCC5)OCC
CCCCCOc1ccc(cc1OCC)C1C(=C(c2ccc3c(c2)OCCO3)(O))C(=O)C(=O)N1CC(NH+)1CCOCC1
InChI=1SC32H40N2O8c13561540249722(2026(24)3942)2928(30(35)238102527(2123)4219184125)31(36)32(37)34(29)121133131638171433h71020212935H361119H212H3b3028+
MFCD18245281
ZINC000102556570
ZINC000102556578
Check stock
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