Vitas-M small molecule compound
(E)-[4-(benzyloxy)-3-methylphenyl][4,5-dioxo-2-(3-phenoxyphenyl)-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Catalog ID
STL038754
SMILES [O-]/C(=C\1/C(=O)C(=O)N(C1c1cccc(c1)Oc1ccccc1)Cc1ccc[nH+]c1)/c1ccc(c(c1)C)OCc1ccccc1
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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 C37H30N2O5 MW 582.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H30N2O5/c1-25-20-29(17-18-32(25)43-24-26-10-4-2-5-11-26)35(40)33-34(39(37(42)36(33)41)23-27-12-9-19-38-22-27)28-13-8-16-31(21-28)44-30-14-6-3-7-15-30/h2-22,34,40H,23-24H2,1H3/b35-33+InChIKey
MIKFLPBWLWJMLE-LAPDZXRHSA-NSynonyms
(4E)4(HYDROXY(3METHYL4PHENYLMETHOXYPHENYL)METHYLIDENE)5(3PHENOXYPHENYL)1(PYRIDIN3YLMETHYL)PYRROLIDINE23DIONE
(E)(4(benzyloxy)3methylphenyl)(45dioxo2(3phenoxyphenyl)1(pyridinium3ylmethyl)pyrrolidin3ylidene)methanolate
(E)(45DIOXO2(3PHENOXYPHENYL)1(PYRIDIN1IUM3YLMETHYL)PYRROLIDIN3YLIDENE)(3METHYL4PHENYLMETHOXYPHENYL)METHANOLATE
(O)C(=C1C(=O)C(=O)N(C1c1cccc(c1)Oc1ccccc1)Cc1ccc(nH+)c1)c1ccc(c(c1)C)OCc1ccccc1
4(4(BENZYLOXY)3METHYLBENZOYL)3HYDROXY5(3PHENOXYPHENYL)1(3PYRIDINYLMETHYL)15DIHYDRO2HPYRROL2ONE
CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)CC3=CN=CC=C3)C4=CC(=CC=C4)OC5=CC=CC=C5)O)OCC6=CC=CC=C6
InChI=1SC37H30N2O5c1252029(171832(25)432426104251126)35(40)3334(39(37(42)36(33)41)232712919382227)281381631(2128)4430146371530h2223440H2324H21H3b3533+
MFCD18247695
ZINC000102862750
ZINC000102862753
Check stock
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