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Ergosterol-d5

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For Research Use Only | Not For Clinical Use
CATAPS007982
SynonymsProvitamin D2-d5, (24R)-Ergosta-5,7,22-trien-3β-ol-d5, 3β-Hydroxyergosta-5,7,22-triene-d5, (22E,24R)-Ergosta-5,7,22-trien-3β-ol-d5, 24R-Methylcholesta-5,7,22E-trien-3β-ol-d5, 24α-Methyl-22E-dehydrocholesterol-d5, Provitamin D-d5,(3β,22E)-Ergosta-5,7,22-trien-3β-ol-d5, 24-Methylcholesta-5,7,22-trien-3β-ol-d5, Ergosterin-d5
IUPAC Name(3S,9S,10R,13R,14R,17R)-2,2,3,4,4-pentadeuterio-10,13-dimethyl-17-[(E,1R,4R)-1,4,5-trimethylhex-2-enyl]-1,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-3-ol
Molecular Weight401.68
Molecular FormulaC28D5H39O
Canonical SMILES[2H]C1([2H])C[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4C3=CC=C2C([2H])([2H])[C@@]1([2H])O)[C@H](C)\C=C\[C@H](C)C(C)C
InChIInChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,18-20,22,24-26,29H,11-17H2,1-6H3/b8-7+/t19-,20+,22-,24+,25-,26-,27-,28+/m0/s1/i13D2,17D2,22D
Accurate Mass401.3706
FormatNeat
Size10MG
SubcategoryStable isotope labelled compounds, Additives and precursors, Drug metabolism
TypeStable Isotope Labelled
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