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all-trans 4-Keto Retinoic Acid-(9-methyl)-d3

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For Research Use Only | Not For Clinical Use
CATAPS1346606265
CAS1346606-26-5
Synonyms4-Ketoretinoic acid (9-methyl-D3), all-trans-4-Oxoretinoic acid-d3, (2E,4E,6E,8E)-3-Methyl-7-(methyl-d3)-9-(2,6,6-trimethyl-3-oxocyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid,4-Oxoretinoic-(9-methyl-d3) acid, 4-Oxo-all-trans-retinoic-d3 acid, 4-Oxotretinoin-d3, 4-keto-Retinoic acid-d3
IUPAC Name(2E,4E,6E,8E)-3-methyl-7-(trideuteriomethyl)-9-(2,6,6-trimethyl-3-oxocyclohexen-1-yl)nona-2,4,6,8-tetraenoic acid
Molecular Weight317.44
Molecular FormulaC202H3H23O3
Canonical SMILES[2H]C([2H])([2H])\C(=C/C=C/C(=C/C(=O)O)/C)\C=C\C1=C(C)C(=O)CCC1(C)C
InChIInChI=1S/C20H26O3/c1-14(7-6-8-15(2)13-19(22)23)9-10-17-16(3)18(21)11-12-20(17,4)5/h6-10,13H,11-12H2,1-5H3,(H,22,23)/b8-6+,10-9+,14-7+,15-13+/i1D3
Accurate Mass317.207
FormatNeat
SubcategoryVitamins and derivatives, Vitamins, Stable isotope labelled compounds
TypeStable Isotope Labelled
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