Table 5.
GC-MS analysis of alkane oxidation by CYP63A2a
Alkane | No. of carbon atoms | Alkane oxidation (%) | Oxidation metabolite (BSTFA derivative) |
||
---|---|---|---|---|---|
MWb | Ion fragmentsc | Metabolited | |||
n-Nonane | 9 | 24.7 | 216.4 | 201, 171, 143, 115, 103, 83, 75, 55, 41 | 1-Nonanol |
n-Decane | 10 | 15.1 | 230.4 | 215, 171, 139, 115, 103, 83, 75 | 1-Decanol |
n-Undecane | 11 | 16.5 | 244.4 | 229, 143, 83, 75, 55 | 1-Undecanol |
n-Dodecane | 12 | 17.0 | 258.5 | 243, 215, 185, 155, 129, 103, 75, 43 | 1-Dodecanol |
n-Pentadecane | 15 | 9.1 | 300.6 | 285, 257, 199, 159, 103, 75, 43 | 1-Pentadecanol |
n-Hexadecane | 16 | 19.8 | —e | NDf | — |
n-Heptadecane | 17 | 30.7 | 328.6 | 313, 238, 199, 167, 103, 75, 43 | 1-Heptadecanol |
n-Octadecane | 18 | 31.1 | — | ND | — |
n-Nonadecane | 19 | 19.9 | 356.7 | 341, 255, 213, 167, 103, 75, 43 | 1-Nonadecanol |
See Fig. S2 in the supplemental material for the GC-MS profiles of metabolites.
MW, molecular weight.
Numbers are m/z values.
Identification of metabolites was performed using a standard NIST traceable MS database, with TMS-derivatized alcohols downloaded from NIST standard reference database number 69 (available at http://webbook.nist.gov/chemistry/).
—, not applicable.
ND, not detected.