Vitas-M small molecule compound
2-[(2,3-dihydroxyphenyl)(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione
Catalog ID
STK016825
SMILES O=C1CC(C)(C)CC(=O)C1C(c1cccc(c1O)O)C1=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 C23H28O6 MW 400.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28O6/c1-22(2)8-14(25)19(15(26)9-22)18(12-6-5-7-13(24)21(12)29)20-16(27)10-23(3,4)11-17(20)28/h5-7,18-19,24,27,29H,8-11H2,1-4H3InChIKey
LFMUVCJTXFHQRO-UHFFFAOYSA-NSynonyms
303768-74-32((23DIHYDROXYPHENYL)(2HYDROXY44DIMETHYL6OXOCYCLOHEX1EN1YL)METHYL)55DIMETHYLCYCLOHEXANE13DIONE
2((23DIHYDROXYPHENYL)(2HYDROXY44DIMETHYL6OXOCYCLOHEXEN1YL)METHYL)55DIMETHYLCYCLOHEXANE13DIONE
2((23DIHYDROXYPHENYL)(6HYDROXY44DIMETHYL2OXOCYCLOHEX1(6)ENYL)METHYL)55DIMETHYLCYCLOHEXANE13DIONE
2((R)(23DIHYDROXYPHENYL)(2HYDROXY44DIMETHYL6OXOCYCLOHEX1EN1YL)METHYL)55DIMETHYLCYCLOHEXANE13DIONE
303768743
CC1(CC(=O)C(C(=O)C1)C(C2=C(C(=CC=C2)O)O)C3=C(CC(CC3=O)(C)C)O)C
InChI=1SC23H28O6c122(2)814(25)19(15(26)922)18(1265713(24)21(12)29)2016(27)1023(34)1117(20)28h571819242729H811H214H3
MFCD00583684
O=C1CC(C)(C)CC(=O)C1C(c1cccc(c1O)O)C1=C(O)CC(CC1=O)(C)C
STK016825
ZINC000100003720
ZINC000100003722
Check stock
See real-time availability and sample size for STK016825 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.