Vitas-M small molecule compound
(E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene}(phenyl)methanolate
Catalog ID
STL148447
SMILES CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2ccccc2)/[O-])/C1c1cc(OC)c(c(c1)OC)OC)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 C27H34N2O6 MW 482.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O6/c1-6-28(7-2)14-11-15-29-23(19-16-20(33-3)26(35-5)21(17-19)34-4)22(25(31)27(29)32)24(30)18-12-9-8-10-13-18/h8-10,12-13,16-17,23,30H,6-7,11,14-15H2,1-5H3/b24-22+InChIKey
SCJTYLRPJSQBPK-ZNTNEXAZSA-NSynonyms
615272-41-8(4E)1(3(DIETHYLAMINO)PROPYL)4(HYDROXY(PHENYL)METHYLIDENE)5(345TRIMETHOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(diethylammonio)propyl)45dioxo2(345trimethoxyphenyl)pyrrolidin3ylidene)(phenyl)methanolate
(E)(1(3(DIETHYLAZANIUMYL)PROPYL)45DIOXO2(345TRIMETHOXYPHENYL)PYRROLIDIN3YLIDENE)PHENYLMETHANOLATE
1(3(DIETHYLAMINO)PROPYL)3HYDROXY4(PHENYLCARBONYL)5(345TRIMETHOXYPHENYL)3PYRROLIN2ONE
615272418
CC(NH+)(CCCN1C(=O)C(=O)C(=C(c2ccccc2)(O))C1c1cc(OC)c(c(c1)OC)OC)CC
CCN(CC)CCCN1C(C(=C(C2=CC=CC=C2)O)C(=O)C1=O)C3=CC(=C(C(=C3)OC)OC)OC
InChI=1SC27H34N2O6c1628(72)1411152923(191620(333)26(355)21(1719)344)22(25(31)27(29)32)24(30)181298101318h810121316172330H67111415H215H3b2422+
MFCD20755398
ZINC000009046717
ZINC000009177031
Check stock
See real-time availability and sample size for STL148447 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.