Vitas-M small molecule compound

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

Catalog ID
STL149345
SMILES CC[NH+](CCN1C(c2cc(OC)c(c(c2)OC)OC)/C(=C(/c2ccc(c(c2)C)OC)\[O-])/C(=O)C1=O)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/c1-8-29(9-2)12-13-30-24(19-15-21(35-5)27(37-7)22(16-19)36-6)23(26(32)28(30)33)25(31)18-10-11-20(34-4)17(3)14-18/h10-11,14-16,24,31H,8-9,12-13H2,1-7H3/b25-23+
InChIKey
RRJPDCDZEAOFHO-WJTDDFOZSA-N
Synonyms
460046-21-3
(4E)1(2(diethylamino)ethyl)4(hydroxy(4methoxy3methylphenyl)methylidene)5(345trimethoxyphenyl)pyrrolidine23dione
(4E)1(2DIETHYLAMINOETHYL)4(HYDROXY(4METHOXY3METHYLPHENYL)METHYLIDENE)5(345TRIMETHOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)45dioxo2(345trimethoxyphenyl)pyrrolidin3ylidene)(4methoxy3methylphenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXO2(345TRIMETHOXYPHENYL)PYRROLIDIN3YLIDENE)(4METHOXY3METHYLPHENYL)METHANOLATE
460046213
CC(NH+)(CCN1C(c2cc(OC)c(c(c2)OC)OC)C(=C(c2ccc(c(c2)C)OC)(O))C(=O)C1=O)CC
CCN(CC)CCN1C(C(=C(C2=CC(=C(C=C2)OC)C)O)C(=O)C1=O)C3=CC(=C(C(=C3)OC)OC)OC
InChI=1SC28H36N2O7c1829(92)12133024(191521(355)27(377)22(1619)366)23(26(32)28(30)33)25(31)18101120(344)17(3)1418h101114162431H891213H217H3b2523+
MFCD20755584
ZINC000009045727
ZINC000102929098

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Available files

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