Vitas-M small molecule compound
ethyl {4-[(4,4-dimethyl-2,6-dioxocyclohexyl)(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]phenoxy}acetate
Catalog ID
STK673117
SMILES CCOC(=O)COc1ccc(cc1)C(C1=C(O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C
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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 C27H34O7 MW 470.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34O7/c1-6-33-22(32)15-34-17-9-7-16(8-10-17)23(24-18(28)11-26(2,3)12-19(24)29)25-20(30)13-27(4,5)14-21(25)31/h7-10,23-24,30H,6,11-15H2,1-5H3InChIKey
PCVOEVINOAWKRJ-UHFFFAOYSA-NSynonyms
CCOC(=O)COC1=CC=C(C=C1)C(C2C(=O)CC(CC2=O)(C)C)C3=C(CC(CC3=O)(C)C)O
ethyl(4((44dimethyl26dioxocyclohexyl)(2hydroxy44dimethyl6oxocyclohex1en1yl)methyl)phenoxy)acetate
ETHYL2(4((44DIMETHYL26DIOXOCYCLOHEXYL)(2HYDROXY44DIMETHYL6OXOCYCLOHEXEN1YL)METHYL)PHENOXY)ACETATE
InChI=1SC27H34O7c163322(32)1534179716(81017)23(2418(28)1126(23)1219(24)29)2520(30)1327(45)1421(25)31h710232430H61115H215H3
MFCD00828194
ZINC000100056065
ZINC000100056067
Check stock
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