Vitas-M small molecule compound

(3Z,5E)-1-methyl-3,5-bis(2,3,4-trimethoxybenzylidene)piperidin-4-one

Catalog ID
STK854717
SMILES COc1c(ccc(c1OC)OC)/C=C/1\CN(C)C/C(=C/c2ccc(c(c2OC)OC)OC)/C1=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 C26H31NO7 MW 469.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31NO7/c1-27-14-18(12-16-8-10-20(29-2)25(33-6)23(16)31-4)22(28)19(15-27)13-17-9-11-21(30-3)26(34-7)24(17)32-5/h8-13H,14-15H2,1-7H3/b18-12-,19-13+
InChIKey
QIJNPXNDNGLJPA-MGYAYREDSA-N
Synonyms
380626-08-4
(3E5Z)1methyl35bis(234trimethoxybenzylidene)piperidin4one
(3Z5E)1METHYL35BIS((234TRIMETHOXYPHENYL)METHYLIDENE)PIPERIDIN4ONE
(3Z5E)1methyl35bis(234trimethoxybenzylidene)piperidin4one
380626084
CN1CC(=CC2=C(C(=C(C=C2)OC)OC)OC)C(=O)C(=CC3=C(C(=C(C=C3)OC)OC)OC)C1
COc1c(ccc(c1OC)OC)C=C1CN(C)CC(=Cc2ccc(c(c2OC)OC)OC)C1=O
InChI=1SC26H31NO7c1271418(121681020(292)25(336)23(16)314)22(28)19(1527)131791121(303)26(347)24(17)325h813H1415H217H3b18121913+
MFCD03693652
ZINC000017253968
ZINC17253968

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Available files

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