Vitas-M small molecule compound

(1E,4E)-1,5-bis(4-methoxy-2,3,6-trimethylphenyl)penta-1,4-dien-3-one

Catalog ID
STL512411
SMILES COc1cc(C)c(c(c1C)C)/C=C/C(=O)/C=C/c1c(C)cc(c(c1C)C)OC

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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 C25H30O3 MW 378.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30O3/c1-15-13-24(27-7)19(5)17(3)22(15)11-9-21(26)10-12-23-16(2)14-25(28-8)20(6)18(23)4/h9-14H,1-8H3/b11-9+,12-10+
InChIKey
IQSMUGLYXYXCNO-WGDLNXRISA-N
Synonyms

(1~(E)4~(E))15bis(4methoxy236trimethylphenyl)penta14dien3one
(1E4E)15bis(4methoxy236trimethylphenyl)penta14dien3one
1760886
374703987
COc1cc(C)c(c(c1C)C)C=CC(=O)C=Cc1c(C)cc(c(c1C)C)OC
InChI=1SC25H30O3c1151324(277)19(5)17(3)22(15)11921(26)10122316(2)1425(288)20(6)18(23)4h914H18H3b119+1210+
MFCD01082234
ZINC000002105862
ZINC2105862

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Available files

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