Vitas-M small molecule compound

2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione

Catalog ID
STL257122
SMILES O=C1CC(C)(C)CC(=O)C1CC1=C(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 C17H24O4 MW 292.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H24O4/c1-16(2)6-12(18)10(13(19)7-16)5-11-14(20)8-17(3,4)9-15(11)21/h10,20H,5-9H2,1-4H3
InChIKey
FUBBMUWBTVRWRE-UHFFFAOYSA-N
Synonyms

2((2HYDROXY44DIMETHYL6OXO1CYCLOHEXEN1YL)METHYL)55DIMETHYL13CYCLOHEXANEDIONE
2((2hydroxy44dimethyl6oxocyclohex1en1yl)methyl)55dimethylcyclohexane13dione
2((2HYDROXY44DIMETHYL6OXOCYCLOHEXEN1YL)METHYL)55DIMETHYLCYCLOHEXANE13DIONE
2((6HYDROXY44DIMETHYL2OXOCYCLOHEX1(6)ENYL)METHYL)55DIMETHYLCYCLOHEXANE13DIONE
CC1(CC(=O)C(C(=O)C1)CC2=C(CC(CC2=O)(C)C)O)C
InChI=1SC17H24O4c116(2)612(18)10(13(19)716)51114(20)817(34)915(11)21h1020H59H214H3
MFCD00418678
ZINC000100036117
ZINC100036117

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Available files

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