Vitas-M small molecule compound
5-(4-butoxyphenyl)-3-[(E)-2-(4-butoxyphenyl)ethenyl]cyclohex-2-en-1-one
Catalog ID
STL512200
SMILES CCCCOc1ccc(cc1)/C=C/C1=CC(=O)CC(C1)c1ccc(cc1)OCCCC
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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 C28H34O3 MW 418.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34O3/c1-3-5-17-30-27-13-9-22(10-14-27)7-8-23-19-25(21-26(29)20-23)24-11-15-28(16-12-24)31-18-6-4-2/h7-16,20,25H,3-6,17-19,21H2,1-2H3/b8-7+InChIKey
CBJVCGUDTVVKIW-BQYQJAHWSA-NSynonyms
374703-80-7(E)4butoxy5(4butoxystyryl)16dihydro(11biphenyl)3(2H)one
374703807
5(4butoxyphenyl)3((~(E))2(4butoxyphenyl)ethenyl)cyclohex2en1one
5(4butoxyphenyl)3((E)2(4butoxyphenyl)ethenyl)cyclohex2en1one
5901698
CCCCOc1ccc(cc1)C=CC1=CC(=O)CC(C1)c1ccc(cc1)OCCCC
InChI=1SC28H34O3c13517302713922(101427)78231925(2126(29)2023)24111528(161224)3118642h7162025H36171921H212H3b87+
MFCD00568223
ZINC000002105756
ZINC000002105760
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