Vitas-M small molecule compound
(E)-[4-(benzyloxy)-2-methylphenyl][2-(4-ethoxy-3-methoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Catalog ID
STL149234
SMILES CCOc1ccc(cc1OC)C1N(Cc2ccc[nH+]c2)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OCc1ccccc1)/[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 C34H32N2O6 MW 564.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H32N2O6/c1-4-41-28-15-12-25(18-29(28)40-3)31-30(33(38)34(39)36(31)20-24-11-8-16-35-19-24)32(37)27-14-13-26(17-22(27)2)42-21-23-9-6-5-7-10-23/h5-19,31,37H,4,20-21H2,1-3H3/b32-30+InChIKey
DPGSAZKAHJVBMM-NHQGMKOOSA-NSynonyms
(4E)5(4ETHOXY3METHOXYPHENYL)4(HYDROXY(2METHYL4PHENYLMETHOXYPHENYL)METHYLIDENE)1(PYRIDIN3YLMETHYL)PYRROLIDINE23DIONE
(E)(2(4ETHOXY3METHOXYPHENYL)45DIOXO1(PYRIDIN1IUM3YLMETHYL)PYRROLIDIN3YLIDENE)(2METHYL4PHENYLMETHOXYPHENYL)METHANOLATE
(E)(4(benzyloxy)2methylphenyl)(2(4ethoxy3methoxyphenyl)45dioxo1(pyridinium3ylmethyl)pyrrolidin3ylidene)methanolate
4(4(BENZYLOXY)2METHYLBENZOYL)5(4ETHOXY3METHOXYPHENYL)3HYDROXY1(PYRIDIN3YLMETHYL)1HPYRROL2(5H)ONE
CCOC1=C(C=C(C=C1)C2C(=C(C3=C(C=C(C=C3)OCC4=CC=CC=C4)C)(O))C(=O)C(=O)N2CC5=C(NH+)=CC=C5)OC
CCOc1ccc(cc1OC)C1N(Cc2ccc(nH+)c2)C(=O)C(=O)C1=C(c1ccc(cc1C)OCc1ccccc1)(O)
InChI=1SC34H32N2O6c144128151225(1829(28)403)3130(33(38)34(39)36(31)202411816351924)32(37)27141326(1722(27)2)42212396571023h5193137H42021H213H3b3230+
MFCD20755559
ZINC000102931462
ZINC000102931465
Check stock
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