Table 2.
Summary of all metabolites of APM in vitro and in vivoa.
| ID | Description | Formula [M + H]+ | Observed m/z | Retention time (min) | Mass error (mDa) | Mass error (ppm) | Major fragments | In vitro-microsome | In vivo-rat | In vivo-chicken | |||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Human | Rat | Pig | Chicken | Dog | Plasma | Urine | Feces | Plasma | Feces | ||||||||
| M0 | APM | C28H39NO4S+ | 486.2675 | 13.7 | 0.2 | 0.5 | 184.04, 303.23, 285.22, 124.02, 267.21, 166.03 | + | + | + | + | + | + | + | + | + | + |
| M1 | APM + O | C28H39NO5S+ | 502.2624 | 9.1 | 0.3 | 0.5 | 109.05, 200.04, 140.02, 303.23 | + | + | + | + | + | + | + | + | + | + |
| M2 | APM-Sulfoxide | C28H39NO5S+ | 502.2620 | 11.9 | −0.2 | −0.3 | 200.04, 182.04, 140.02, 303.23, | + | + | + | + | + | + | ND | + | + | + |
| M3 | APM + O | C28H39NO5S+ | 502.2644 | 10.0 | 2.3 | 4.5 | 184.04, 166.03, 301.22 | + | + | ND | ND | + | ND | ND | ND | ND | ND |
| M4 | APM + O | C28H39NO5S+ | 502.2607 | 10.6 | −1.5 | −2.9 | 184.04, 166.03, 319.23, 301.22 | + | + | + | + | + | ND | + | ND | ND | + |
| M5 | APM + O | C28H39NO5S+ | 502.2625 | 11.3 | 0.3 | 0.7 | 184.04, 124.02, 166.03, 301.22 | + | + | + | + | + | + | + | + | + | + |
| M6 | APM + O | C28H39NO5S+ | 502.2640 | 12.7 | 1.8 | 3.6 | 184.04, 301.22, 337.24 | ND | + | ND | ND | + | ND | ND | ND | ND | ND |
| M7 | APM + 2O | C28H39NO6S+ | 518.2575 | 6.1 | 0.4 | 0.8 | 200.04, 109.05, 319.23, 140.02 | + | + | + | ND | + | ND | + | + | + | + |
| M8 | APM + 2O | C28H39NO6S+ | 518.2582 | 6.9 | 1.1 | 2.1 | 200.04, 319.23, 109.05, 140.02 | + | ND | + | ND | ND | + | + | + | + | + |
| M9 | APM-Sulfoxide + O | C28H39NO6S+ | 518.2582 | 7.3 | 1.1 | 2.2 | 200.04, 301.22, 353.25 | ND | ND | ND | ND | ND | ND | ND | + | + | + |
| M10 | APM-Sulfoxide + O | C28H39NO6S+ | 518.2577 | 8.1 | 0.7 | 1.3 | 200.04, 182.03, 140.02, 301.22 | + | + | + | ND | + | ND | + | ND | ND | ND |
| M11 | APM-Sulfoxide + O | C28H39NO6S+ | 518.2574 | 8.6 | 0.3 | 0.7 | 200.04, 301.22, 162.91 | + | + | + | ND | ND | ND | ND | ND | ND | ND |
| M12 | APM-Sulfoxide + O | C28H39NO6S+ | 518.2571 | 8.9 | 0.0 | 0.0 | 200.04, 182.03, 140.02, 301.22 | + | + | + | + | + | ND | + | + | + | + |
| M13 | APM-Sulfoxide + O | C28H39NO6S+ | 518.2575 | 9.7 | 0.4 | 0.8 | 200.04, 182.03, 140.02, 319.23 | + | ND | + | + | ND | + | + | + | + | + |
| M14 | APM-Sulfoxide + O | C28H39NO6S+ | 518.2576 | 10.0 | 0.6 | 1.1 | 200.04, 182.03, 140.02, 301.22 | + | ND | + | + | ND | ND | + | + | + | + |
| M15 | APM + 2O | C28H39NO6S+ | 518.2558 | 9.5 | −1.3 | −2.5 | 184.04, 166.07, 317.21, 299.20 | ND | + | ND | ND | + | ND | + | ND | ND | ND |
| M16 | APM + 2O | C28H39NO6S+ | 518.2573 | 10.3 | 0.3 | 0.6 | 184.04, 335.22, 299.20, 155.1 | + | + | + | ND | + | ND | + | ND | ND | ND |
| M17 | APM-sulfoxide + 2O | C28H39NO7S+ | 534.2527 | 5.4 | 0.7 | 1.3 | 200.04, 317.21, 140.02, 295.09 | + | + | + | ND | ND | ND | + | + | ND | + |
| M18 | APM-sulfoxide + 2O | C28H39NO7S+ | 534.2532 | 5.7 | 1.2 | 2.3 | 200.04, 335.22, 317.21, 299.20 | ND | ND | ND | ND | ND | ND | ND | + | + | + |
| M19 | APM-sulfoxide + 2O | C28H39NO7S+ | 534.2509 | 7.2 | −1.0 | −1.9 | 182.03, 200.04, 317.21, 395.24 | ND | ND | ND | ND | ND | ND | + | ND | ND | + |
| M20 | APM-sulfoxide + 2O | C28H39NO7S+ | 534.2523 | 8.1 | 0.3 | 0.7 | 200.04, 317.21, 182.03 | + | + | + | ND | ND | ND | ND | + | ND | + |
| M21 | APM-sulfoxide + 2O | C28H39NO7S+ | 534.2517 | 7.7 | −0.3 | −0.5 | 200.04, 317.21, 166.03, 299.13 | ND | ND | ND | ND | ND | ND | + | + | ND | + |
| M22 | APM + 3O | C28H39NO7S+ | 534.2520 | 8.5 | 0.0 | 0.1 | 184.04, 299.13, 333.21 | ND | ND | ND | ND | ND | ND | + | + | ND | + |
| M23 | APM + 3O | C28H39NO7S+ | 534.2540 | 9.5 | 2.1 | 3.9 | 184.04, 333.21, 315.20, 180.10 | ND | ND | ND | ND | ND | ND | ND | + | ND | ND |
| M24 | APM-sulfone + O | C28H39NO7S+ | 534.2522 | 10.2 | 0.2 | 0.4 | 109.05, 232.02, 303.23, 285.22 | + | ND | ND | ND | ND | ND | ND | + | + | + |
| M25 | APM-sulfone + O | C28H39NO7S+ | 534.2509 | 10.9 | −0.1 | −0.2 | 109.05, 232.02, 303.23, 267.21 | ND | ND | ND | ND | ND | ND | ND | + | ND | ND |
| M26 | APM-sulfoxide + 3O | C28H39NO8S+ | 550.2467 | 7.5 | −0.2 | −0.4 | 351.24, 200.04, 315.20, 331.08 | ND | ND | ND | ND | ND | ND | ND | + | ND | ND |
| M27 | APM-sulfone + 2O | C28H39NO8S+ | 550.2474 | 8.0 | 0.5 | 0.9 | 109.05, 232.02, 301.22, 319.23 | ND | ND | ND | ND | ND | ND | ND | + | ND | ND |
+, detected; ND, undetected.