Vitas-M small molecule compound
(E)-[4-(benzyloxy)phenyl]{1-[2-(dimethylammonio)ethyl]-2-(4-hydroxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL055290
SMILES C[NH+](CCN1C(c2ccc(cc2)O)/C(=C(/c2ccc(cc2)OCc2ccccc2)\[O-])/C(=O)C1=O)C
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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 C28H28N2O5 MW 472.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O5/c1-29(2)16-17-30-25(20-8-12-22(31)13-9-20)24(27(33)28(30)34)26(32)21-10-14-23(15-11-21)35-18-19-6-4-3-5-7-19/h3-15,25,31-32H,16-18H2,1-2H3/b26-24+InChIKey
YYPBJROCEHJCAM-SHHOIMCASA-NSynonyms
(4E)1(2(dimethylamino)ethyl)5(4hydroxyphenyl)4(hydroxy(4phenylmethoxyphenyl)methylidene)pyrrolidine23dione
(4E)1(2DIMETHYLAMINOETHYL)5(4HYDROXYPHENYL)4(HYDROXY(4PHENYLMETHOXYPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(4HYDROXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4PHENYLMETHOXYPHENYL)METHANOLATE
(E)(4(benzyloxy)phenyl)(1(2(dimethylammonio)ethyl)2(4hydroxyphenyl)45dioxopyrrolidin3ylidene)methanolate
C(NH+)(CCN1C(c2ccc(cc2)O)C(=C(c2ccc(cc2)OCc2ccccc2)(O))C(=O)C1=O)C
CN(C)CCN1C(C(=C(C2=CC=C(C=C2)OCC3=CC=CC=C3)O)C(=O)C1=O)C4=CC=C(C=C4)O
InChI=1SC28H28N2O5c129(2)16173025(2081222(31)13920)24(27(33)28(30)34)26(32)21101423(151121)3518196435719h315253132H1618H212H3b2624+
MFCD18249668
ZINC000009328555
ZINC000009328556
Check stock
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Check stock on Vitas-MAvailable files
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