Vitas-M small molecule compound
2-(6,6-dimethyl-4-oxo-2,3,4,5,6,7-hexahydro-1-benzofuran-3-yl)-5,5-dimethylcyclohexane-1,3-dione
Catalog ID
STL548097
SMILES O=C1CC(C)(C)CC(=O)C1C1COC2=C1C(=O)CC(C2)(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 C18H24O4 MW 304.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24O4/c1-17(2)5-11(19)15(12(20)6-17)10-9-22-14-8-18(3,4)7-13(21)16(10)14/h10,15H,5-9H2,1-4H3InChIKey
GIQGPYDPRLFQNK-UHFFFAOYSA-NSynonyms
6049-53-22(66dimethyl4oxo234567hexahydro1benzofuran3yl)55dimethylcyclohexane13dione
2(66dimethyl4oxo234567hexahydrobenzofuran3yl)55dimethylcyclohexane13dione
2(66dimethyl4oxo2357tetrahydro1benzofuran3yl)55dimethylcyclohexane13dione
2882805
6049532
InChI=1SC18H24O4c117(2)511(19)15(12(20)617)1092214818(34)713(21)16(10)14h1015H59H214H3
MFCD01844692
ZINC000100743488
ZINC000100743489
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