Vitas-M small molecule compound
(E)-(2-methylimidazo[1,2-a]pyridin-3-yl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene}methanolate
Catalog ID
STL046835
SMILES COc1c(OC)cc(cc1OC)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1c(C)nc2n1cccc2)/[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 C28H32N4O7 MW 536.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O7/c1-17-23(31-8-6-5-7-21(31)29-17)25(33)22-24(18-15-19(36-2)27(38-4)20(16-18)37-3)32(28(35)26(22)34)10-9-30-11-13-39-14-12-30/h5-8,15-16,24,33H,9-14H2,1-4H3/b25-22+InChIKey
RKFSTWZGZQOTDT-YYDJUVGSSA-NSynonyms
630064-01-6(4E)4(HYDROXY(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)5(345TRIMETHOXYPHENYL)PYRROLIDINE23DIONE
(E)(2methylimidazo(12a)pyridin3yl)(1(2(morpholin4ium4yl)ethyl)45dioxo2(345trimethoxyphenyl)pyrrolidin3ylidene)methanolate
(E)(2METHYLIMIDAZO(12A)PYRIDIN3YL)(1(2MORPHOLIN4IUM4YLETHYL)45DIOXO2(345TRIMETHOXYPHENYL)PYRROLIDIN3YLIDENE)METHANOLATE
3HYDROXY4((2METHYL(4HYDROIMIDAZO(12A)PYRIDIN3YL))CARBONYL)1(2MORPHOLIN4YLETHYL)5(345TRIMETHOXYPHENYL)3PYRROLIN2ONE
630064016
CC1=C(N2C=CC=CC2=N1)C(=C3C(N(C(=O)C3=O)CC(NH+)4CCOCC4)C5=CC(=C(C(=C5)OC)OC)OC)(O)
COc1c(OC)cc(cc1OC)C1N(CC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1c(C)nc2n1cccc2)(O)
InChI=1SC28H32N4O7c11723(31865721(31)2917)25(33)2224(181519(362)27(384)20(1618)373)32(28(35)26(22)34)10930111339141230h5815162433H914H214H3b2522+
MFCD18248934
ZINC000102881563
ZINC000102881564
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