Vitas-M small molecule compound
dipropan-2-yl 4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Catalog ID
STL240065
SMILES COc1cc(ccc1O)C1C(C(=O)OC(C)C)C(=O)CC(C1C(=O)OC(C)C)(C)O
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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 C22H30O8 MW 422.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30O8/c1-11(2)29-20(25)18-15(24)10-22(5,27)19(21(26)30-12(3)4)17(18)13-7-8-14(23)16(9-13)28-6/h7-9,11-12,17-19,23,27H,10H2,1-6H3InChIKey
FWDVEWRYQLATFP-UHFFFAOYSA-NSynonyms
1005095-16-81005095168
CC(C)OC(=O)C1C(C(C(CC1=O)(C)O)C(=O)OC(C)C)C2=CC(=C(C=C2)O)OC
DIISOPROPYL4HYDROXY2(4HYDROXY3METHOXYPHENYL)4METHYL6OXO13CYCLOHEXANEDICARBOXYLATE
diisopropyl4hydroxy2(4hydroxy3methoxyphenyl)4methyl6oxocyclohexane13dicarboxylate
dipropan2yl4hydroxy2(4hydroxy3methoxyphenyl)4methyl6oxocyclohexane13dicarboxylate
InChI=1SC22H30O8c111(2)2920(25)1815(24)1022(527)19(21(26)3012(3)4)17(18)137814(23)16(913)286h79111217192327H10H216H3
MFCD02049836
ZINC000004112414
ZINC000245245675
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