Vitas-M small molecule compound
(E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-[4-(prop-2-en-1-yloxy)phenyl]pyrrolidin-3-ylidene}methanolate
Catalog ID
STK565452
SMILES C=CCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCC[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 C29H32N2O7 MW 520.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N2O7/c1-2-14-36-22-7-4-20(5-8-22)26-25(27(32)21-6-9-23-24(19-21)38-18-17-37-23)28(33)29(34)31(26)11-3-10-30-12-15-35-16-13-30/h2,4-9,19,26,32H,1,3,10-18H2/b27-25+InChIKey
ZGMXJAZKDVKDDR-IMVLJIQESA-NSynonyms
618409-38-4(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)5(4PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
(E)23dihydro14benzodioxin6yl(1(3(morpholin4ium4yl)propyl)45dioxo2(4(prop2en1yloxy)phenyl)pyrrolidin3ylidene)methanolate
(E)23DIHYDRO14BENZODIOXIN6YL(1(3MORPHOLIN4IUM4YLPROPYL)45DIOXO2(4PROP2ENOXYPHENYL)PYRROLIDIN3YLIDENE)METHANOLATE
4(2H3HBENZO(34E)14DIOXAN6YLCARBONYL)3HYDROXY1(3MORPHOLIN4YLPROPYL)5(4PROP2ENYLOXYPHENYL)3PYRROLIN2ONE
618409384
C=CCOC1=CC=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCCN5CCOCC5
C=CCOc1ccc(cc1)C1C(=C(c2ccc3c(c2)OCCO3)(O))C(=O)C(=O)N1CCC(NH+)1CCOCC1
InChI=1SC29H32N2O7c121436227420(5822)2625(27(32)21692324(1921)3818173723)28(33)29(34)31(26)1131030121535161330h249192632H131018H2b2725+
MFCD18244791
ZINC000009312287
ZINC000009313072
Check stock
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