Vitas-M small molecule compound
4-{(3E)-1-[2-(diethylammonio)ethyl]-3-[hydroxy(4-methoxy-2-methylphenyl)methylidene]-4,5-dioxopyrrolidin-2-yl}-2-ethoxyphenolate
Catalog ID
STL040328
SMILES CCOc1cc(ccc1[O-])C1N(CC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OC)/O
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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)13-14-29-24(18-9-12-21(30)22(16-18)35-8-3)23(26(32)27(29)33)25(31)20-11-10-19(34-5)15-17(20)4/h9-12,15-16,24,30-31H,6-8,13-14H2,1-5H3/b25-23+InChIKey
HOVWHWDAROQYEB-WJTDDFOZSA-NSynonyms
371115-77-4(4E)1(2(diethylamino)ethyl)5(3ethoxy4hydroxyphenyl)4(hydroxy(4methoxy2methylphenyl)methylidene)pyrrolidine23dione
(4E)1(2DIETHYLAMINOETHYL)5(3ETHOXY4HYDROXYPHENYL)4(HYDROXY(4METHOXY2METHYLPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
371115774
4((3E)1(2(diethylammonio)ethyl)3(hydroxy(4methoxy2methylphenyl)methylidene)45dioxopyrrolidin2yl)2ethoxyphenolate
4((3E)1(2(DIETHYLAZANIUMYL)ETHYL)3(HYDROXY(4METHOXY2METHYLPHENYL)METHYLIDENE)45DIOXOPYRROLIDIN2YL)2ETHOXYPHENOLATE
CCN(CC)CCN1C(C(=C(C2=C(C=C(C=C2)OC)C)O)C(=O)C1=O)C3=CC(=C(C=C3)O)OCC
CCOc1cc(ccc1(O))C1N(CC(NH+)(CC)CC)C(=O)C(=O)C1=C(c1ccc(cc1C)OC)O
InChI=1SC27H34N2O6c1628(72)13142924(1891221(30)22(1618)3583)23(26(32)27(29)33)25(31)20111019(345)1517(20)4h9121516243031H681314H215H3b2523+
MFCD18248008
ZINC000006193534
ZINC000102866024
Check stock
See real-time availability and sample size for STL040328 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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