Vitas-M small molecule compound
(E)-{2-(2,4-dimethoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(4-methoxy-2-methylphenyl)methanolate
Catalog ID
STL148052
SMILES COc1cc(OC)ccc1C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OC)/[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 C27H32N2O7 MW 496.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O7/c1-17-15-18(33-2)5-7-20(17)25(30)23-24(21-8-6-19(34-3)16-22(21)35-4)29(27(32)26(23)31)10-9-28-11-13-36-14-12-28/h5-8,15-16,24,30H,9-14H2,1-4H3/b25-23+InChIKey
LMBSHOYXILCNED-WJTDDFOZSA-NSynonyms
(4E)5(24DIMETHOXYPHENYL)4(HYDROXY(4METHOXY2METHYLPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(2(24dimethoxyphenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)(4methoxy2methylphenyl)methanolate
(E)(2(24DIMETHOXYPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHOXY2METHYLPHENYL)METHANOLATE
5(24DIMETHOXYPHENYL)3HYDROXY4(4METHOXY2METHYLBENZOYL)1(2(4MORPHOLINYL)ETHYL)15DIHYDRO2HPYRROL2ONE
CC1=C(C=CC(=C1)OC)C(=C2C(N(C(=O)C2=O)CCN3CCOCC3)C4=C(C=C(C=C4)OC)OC)O
COc1cc(OC)ccc1C1N(CC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1ccc(cc1C)OC)(O)
InChI=1SC27H32N2O7c1171518(332)5720(17)25(30)2324(218619(343)1622(21)354)29(27(32)26(23)31)10928111336141228h5815162430H914H214H3b2523+
MFCD20755317
ZINC000102926793
ZINC000102926796
Check stock
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Check stock on Vitas-MAvailable files
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