Vitas-M small molecule compound
(E)-[2-(2,3-dimethoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](4-propoxyphenyl)methanolate
Catalog ID
STL041515
SMILES CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1OC)OC)Cc1ccc[nH+]c1)/[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 C28H28N2O6 MW 488.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O6/c1-4-15-36-20-12-10-19(11-13-20)25(31)23-24(21-8-5-9-22(34-2)27(21)35-3)30(28(33)26(23)32)17-18-7-6-14-29-16-18/h5-14,16,24,31H,4,15,17H2,1-3H3/b25-23+InChIKey
IXBHETSOZXWSGS-WJTDDFOZSA-NSynonyms
848672-57-1(4E)5(23DIMETHOXYPHENYL)4(HYDROXY(4PROPOXYPHENYL)METHYLIDENE)1(PYRIDIN3YLMETHYL)PYRROLIDINE23DIONE
(E)(2(23DIMETHOXYPHENYL)45DIOXO1(PYRIDIN1IUM3YLMETHYL)PYRROLIDIN3YLIDENE)(4PROPOXYPHENYL)METHANOLATE
(E)(2(23dimethoxyphenyl)45dioxo1(pyridinium3ylmethyl)pyrrolidin3ylidene)(4propoxyphenyl)methanolate
5(23DIMETHOXYPHENYL)3HYDROXY4(4PROPOXYBENZOYL)1(3PYRIDINYLMETHYL)15DIHYDRO2HPYRROL2ONE
848672571
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC3=C(NH+)=CC=C3)C4=C(C(=CC=C4)OC)OC)(O)
CCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccc(c1OC)OC)Cc1ccc(nH+)c1)(O)
InChI=1SC28H28N2O6c14153620121019(111320)25(31)2324(2185922(342)27(21)353)30(28(33)26(23)32)17187614291618h514162431H41517H213H3b2523+
MFCD18248107
ZINC000102867636
ZINC000102867637
Check stock
See real-time availability and sample size for STL041515 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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