Vitas-M small molecule compound
2-[1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)propyl]-5,5-dimethylcyclohexane-1,3-dione
Catalog ID
STK050660
SMILES CCC(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 C19H28O4 MW 320.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H28O4/c1-6-11(16-12(20)7-18(2,3)8-13(16)21)17-14(22)9-19(4,5)10-15(17)23/h11,16,22H,6-10H2,1-5H3InChIKey
YSNKCMAKCWTKQQ-UHFFFAOYSA-NSynonyms
2((6HYDROXY44DIMETHYL2OXOCYCLOHEX1(6)ENYL)PROPYL)55DIMETHYLCYCLOHEXANE13DIONE
2(1(2HYDROXY44DIMETHYL6OXO1CYCLOHEXEN1YL)PROPYL)55DIMETHYL13CYCLOHEXANEDIONE
2(1(2HYDROXY44DIMETHYL6OXOCYCLOHEX1EN1YL)PROPYL)55DIMETHYLCYCLOHEXANE13DIONE
2(1(2HYDROXY44DIMETHYL6OXOCYCLOHEXEN1YL)PROPYL)55DIMETHYLCYCLOHEXANE13DIONE
CCC(C1=C(O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C
CCC(C1C(=O)CC(CC1=O)(C)C)C2=C(CC(CC2=O)(C)C)O
InChI=1SC19H28O4c1611(1612(20)718(23)813(16)21)1714(22)919(45)1015(17)23h111622H610H215H3
MFCD00399236
STK050660
ZINC000100009457
ZINC000100009459
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