Vitas-M small molecule compound
(E)-(4-methoxyphenyl){1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidin-3-ylidene}methanolate
Catalog ID
STL147877
SMILES C=CCOc1cccc(c1)C1/C(=C(/c2ccc(cc2)OC)\[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 C28H32N2O6 MW 492.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2O6/c1-3-16-36-23-7-4-6-21(19-23)25-24(26(31)20-8-10-22(34-2)11-9-20)27(32)28(33)30(25)13-5-12-29-14-17-35-18-15-29/h3-4,6-11,19,25,31H,1,5,12-18H2,2H3/b26-24+InChIKey
HBBQBBRNMIKENU-SHHOIMCASA-NSynonyms
614747-78-3(4E)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)5(3PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
(4Z)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)5(3PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
(E)(4methoxyphenyl)(1(3(morpholin4ium4yl)propyl)45dioxo2(3(prop2en1yloxy)phenyl)pyrrolidin3ylidene)methanolate
(E)(4METHOXYPHENYL)(1(3MORPHOLIN4IUM4YLPROPYL)45DIOXO2(3PROP2ENOXYPHENYL)PYRROLIDIN3YLIDENE)METHANOLATE
3HYDROXY4((4METHOXYPHENYL)CARBONYL)1(3MORPHOLIN4YLPROPYL)5(3PROP2ENYLOXYPHENYL)3PYRROLIN2ONE
614747783
C=CCOc1cccc(c1)C1C(=C(c2ccc(cc2)OC)(O))C(=O)C(=O)N1CCC(NH+)1CCOCC1
COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC(=CC=C4)OCC=C)O
InChI=1SC28H32N2O6c1316362374621(1923)2524(26(31)2081022(342)11920)27(32)28(33)30(25)1351229141735181529h34611192531H151218H22H3b2624+
MFCD20755281
ZINC000101313495
ZINC000101313499
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