Vitas-M small molecule compound
2-{(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)[3-(hydroxymethyl)-4-methoxyphenyl]methyl}-5,5-dimethylcyclohexane-1,3-dione
Catalog ID
STK723040
SMILES COc1ccc(cc1CO)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 C25H32O6 MW 428.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32O6/c1-24(2)9-16(27)22(17(28)10-24)21(14-6-7-20(31-5)15(8-14)13-26)23-18(29)11-25(3,4)12-19(23)30/h6-8,21-22,26,29H,9-13H2,1-5H3InChIKey
UVAGNMCEZQXRBQ-UHFFFAOYSA-NSynonyms
2((2hydroxy44dimethyl6oxocyclohex1en1yl)(3(hydroxymethyl)4methoxyphenyl)methyl)55dimethylcyclohexane13dione
2((2HYDROXY44DIMETHYL6OXOCYCLOHEXEN1YL)(3(HYDROXYMETHYL)4METHOXYPHENYL)METHYL)55DIMETHYLCYCLOHEXANE13DIONE
2((6HYDROXY44DIMETHYL2OXOCYCLOHEX1(6)ENYL)(3(HYDROXYMETHYL)4METHOXYPHENYL)METHYL)55DIMETHYLCYCLOHEXANE13DIONE
CC1(CC(=O)C(C(=O)C1)C(C2=CC(=C(C=C2)OC)CO)C3=C(CC(CC3=O)(C)C)O)C
InChI=1SC25H32O6c124(2)916(27)22(17(28)1024)21(146720(315)15(814)1326)2318(29)1125(34)1219(23)30h6821222629H913H215H3
MFCD02763811
ZINC000100117169
ZINC000100117171
Check stock
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