Vitas-M small molecule compound
(E)-{1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-(3-phenoxyphenyl)pyrrolidin-3-ylidene}(4-methoxy-3-methylphenyl)methanolate
Catalog ID
STK561788
SMILES CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/[O-])/C1c1cccc(c1)Oc1ccccc1)CC
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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 C31H34N2O5 MW 514.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H34N2O5/c1-5-32(6-2)17-18-33-28(22-11-10-14-25(20-22)38-24-12-8-7-9-13-24)27(30(35)31(33)36)29(34)23-15-16-26(37-4)21(3)19-23/h7-16,19-20,28,34H,5-6,17-18H2,1-4H3/b29-27+InChIKey
AJRIINFKTVJCCX-ORIPQNMZSA-NSynonyms
500147-27-3(4E)1(2DIETHYLAMINOETHYL)4(HYDROXY(4METHOXY3METHYLPHENYL)METHYLIDENE)5(3PHENOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)45dioxo2(3phenoxyphenyl)pyrrolidin3ylidene)(4methoxy3methylphenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXO2(3PHENOXYPHENYL)PYRROLIDIN3YLIDENE)(4METHOXY3METHYLPHENYL)METHANOLATE
500147273
CC(NH+)(CC)CCN1C(C(=C(C2=CC(=C(C=C2)OC)C)(O))C(=O)C1=O)C3=CC(=CC=C3)OC4=CC=CC=C4
CC(NH+)(CCN1C(=O)C(=O)C(=C(c2ccc(c(c2)C)OC)(O))C1c1cccc(c1)Oc1ccccc1)CC
InChI=1SC31H34N2O5c1532(62)17183328(2211101425(2022)3824128791324)27(30(35)31(33)36)29(34)23151626(374)21(3)1923h71619202834H561718H214H3b2927+
MFCD18243888
ZINC000102507003
ZINC000102507011
Check stock
See real-time availability and sample size for STK561788 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.