Vitas-M small molecule compound

(E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene}(3-methoxyphenyl)methanolate

Catalog ID
STL038986
SMILES CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2cccc(c2)OC)/[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 C28H36N2O7 MW 512.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N2O7/c1-7-29(8-2)13-10-14-30-24(19-16-21(35-4)27(37-6)22(17-19)36-5)23(26(32)28(30)33)25(31)18-11-9-12-20(15-18)34-3/h9,11-12,15-17,24,31H,7-8,10,13-14H2,1-6H3/b25-23+
InChIKey
CDMJNCBPGPQGHQ-WJTDDFOZSA-N
Synonyms
609324-89-2
(4E)1(3(DIETHYLAMINO)PROPYL)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)5(345TRIMETHOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(diethylammonio)propyl)45dioxo2(345trimethoxyphenyl)pyrrolidin3ylidene)(3methoxyphenyl)methanolate
(E)(1(3(DIETHYLAZANIUMYL)PROPYL)45DIOXO2(345TRIMETHOXYPHENYL)PYRROLIDIN3YLIDENE)(3METHOXYPHENYL)METHANOLATE
1(3(DIETHYLAMINO)PROPYL)3HYDROXY4((3METHOXYPHENYL)CARBONYL)5(345TRIMETHOXYPHENYL)3PYRROLIN2ONE
609324892
CC(NH+)(CCCN1C(=O)C(=O)C(=C(c2cccc(c2)OC)(O))C1c1cc(OC)c(c(c1)OC)OC)CC
CCN(CC)CCCN1C(C(=C(C2=CC(=CC=C2)OC)O)C(=O)C1=O)C3=CC(=C(C(=C3)OC)OC)OC
InChI=1SC28H36N2O7c1729(82)1310143024(191621(354)27(376)22(1719)365)23(26(32)28(30)33)25(31)181191220(1518)343h9111215172431H78101314H216H3b2523+
MFCD18247745
ZINC000102862175
ZINC000102862177

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Available files

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