Vitas-M small molecule compound
(E)-(4-methoxyphenyl){1-[3-(morpholin-4-ium-4-yl)propyl]-2-(2-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK563052
SMILES COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1[N+](=O)[O-])CCC[NH+]1CCOCC1)/[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 C25H27N3O7 MW 481.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O7/c1-34-18-9-7-17(8-10-18)23(29)21-22(19-5-2-3-6-20(19)28(32)33)27(25(31)24(21)30)12-4-11-26-13-15-35-16-14-26/h2-3,5-10,22,29H,4,11-16H2,1H3/b23-21+InChIKey
VSTHEAFOMFRFFX-XTQSDGFTSA-NSynonyms
(4E)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)5(2NITROPHENYL)PYRROLIDINE23DIONE
(E)(4methoxyphenyl)(1(3(morpholin4ium4yl)propyl)2(2nitrophenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(4METHOXYPHENYL)(1(3MORPHOLIN4IUM4YLPROPYL)2(2NITROPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC=CC=C4(N+)(=O)(O))O
COc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccccc1(N+)(=O)(O))CCC(NH+)1CCOCC1)(O)
InChI=1SC25H27N3O7c134189717(81018)23(29)2122(19523620(19)28(32)33)27(25(31)24(21)30)1241126131535161426h235102229H41116H21H3b2321+
MFCD18244202
ZINC000102517443
ZINC000102517452
Check stock
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