Skip to main content
. 2020 Aug 18;11:1024. doi: 10.3389/fphys.2020.01024

TABLE 2.

The differential metabolites identified in hemolymph.

Metabolites m/z RT(min) Adducts Formula Score P FM15/FM25 FM5/FM25
Positive
PC(18:0/0:0) 524.3703 11.55 M + H C26H54NO7P 48.7 0.00 0.45 0.29
PC(14:0/20:5) 752.5216 14.33 M + H C42H74NO8P 53.9 0.00 0.48 0.15
PC(18:2/20:5) 826.5355 14.57 M + H C46H78NO8P 44.4 0.00 0.47 0.17
PC(14:1/22:6) 776.5221 14.7 M + H C44H74NO8P 48.3 0.00 0.63 0.28
PC(P-16:0/18:4) 760.5224 14.71 M + H C42H76NO7P 52.6 0.00 0.44 0.18
PC(14:0/18:2) 820.5112 14.76 M + H C40H76NO8P 45 0.00 0.77 0.43
PC(16:1/18:2) 778.5346 14.87 M + H C42H78NO8P 52.4 0.00 0.78 0.40
PE(18:3/22:4) 790.5397 14.95 M + H C45H76NO8P 42.1 0.00 0.76 0.40
PC(16:0/22:6) 828.5493 15.19 M + H C46H80NO8P 50.8 0.00 0.57 0.28
PC(14:0/18:1) 754.5335 15.27 M + H C40H78NO8P 42.6 0.00 0.88 0.56
PC(18:2/22:5) 854.5643 15.28 M + H C48H82NO8P 48.8 0.00 0.53 0.25
SM(d17:1/17:0) 725.5538 15.31 M + H C39H79N2O6P 53.5 0.00 1.43 1.60
PC(P-16:0/20:4) 788.5516 15.37 M + H C44H80NO7P 54.6 0.00 0.59 0.28
PS(18:0/20:3) 814.5637 15.69 M + H C44H80NO10P 48.1 0.00 0.71 0.43
PE(18:0/22:6) 840.5783 15.75 M + CH3OH + H C45H78NO9P 51 0.00 0.53 0.31
LacCer(d18:1/14:0) 816.5819 15.93 M + H - H2O C44H83NO13 40.4 0.00 0.60 0.30
LacCer(d18:1/14:0) 856.5773 15.98 M + H C44H83NO13 41.5 0.00 0.59 0.35
PC(20:3/P-18:1) 794.5981 16.25 M + H C46H84NO7P 45.2 0.00 0.58 0.38
PS(21:0/20:5) 884.5988 16.59 M + CH3OH + H C47H82NO10P 46.1 0.00 0.60 0.39
LacCer(d18:1/16:0) 844.6112 16.97 M + H - H2O C46H87NO13 44.1 0.00 0.46 0.21
Oceanalin A 864.6049 18.01 M + H C41H72N2O9 52.2 0.00 1.59 2.18
DAT(16:0/23:0) 927.7087 18.15 M + H - H2O C53H100O13 44.2 0.00 12.09 12.89
Cer(d18:1/24:1) 912.6259 18.18 M + H - H2O C48H91NO11S 42.7 0.00 0.75 0.55
PC(22:0/16:1) 838.6227 18.34 M + H C46H90NO8P 44 0.00 1.65 1.82
TG(18:4/18:4/20:4) 927.7082 18.67 M + CH3OH + H C59H90O6 40.1 0.00 5.25 4.77
Negative
Diethylenetriamine 509.2746 1.99 2M - H C14H22ClNO 48.9 0.00 0.89 3.04
Crustecdysone 525.3059 2.12 M - H, M + FA - H C27H44O7 57.6 0.00 0.89 3.87
2-ethyl butanoate 258.0793 2.21 M + FA - H C10H15NO2S 51.8 0.00 0.49 0.11
Monocrotaline 324.1474 2.21 M - H C16H23NO6 48.7 0.01 1.54 1.45
Macaridine 260.0941 2.31 M + FA - H C13H13NO2 54 0.00 0.43 0.16
5-Amino-benzopyran-4-one 306.1371 2.38 M - H C16H21NO5 51.5 0.00 3.50 2.83
noroxymorphone 286.1107 2.56 M - H C16H17NO4 51.2 0.00 0.33 0.07
5-Amino-4-chromanone 274.1108 2.96 M - H, M + FA - H C15H17NO4 54 0.00 0.08 0.04
Taurohyocholic acid 514.2841 3.17 M - H C26H45NO7S 40.5 0.00 1.07 0.06
Psychosine sulfate 540.2848 8.65 M - H C24H47NO10S 41.9 0.00 0.24 0.02
N-Undecylbenzenesulfonic acid 311.1674 9.09 M - H C17H28O3S 55.6 0.00 1.18 1.86
4-Dodecylbenzenesulfonic Acid 325.1833 10 M - H C18H30O3S 56.1 0.00 1.24 2.24
LysoPC(16:0) 540.3305 10.09 M + FA - H C24H50NO7P 56.8 0.00 0.46 0.27
LysoPE(0:0/16:0) 452.2772 10.32 M - H C21H44NO7P 40.6 0.00 0.24 0.09
LysoPC(18:1) 566.3459 10.46 M + FA - H C26H52NO7P 58.3 0.00 0.56 0.37
LysoPE(P-16:0) 436.2826 11.01 M - H C21H44NO6P 53 0.00 0.46 0.28
LysoPC(18:0) 568.3621 11.54 M + FA - H C26H54NO7P 56.2 0.00 0.47 0.28
LysoPC(O-18:0) 554.3822 12.08 M + FA - H C26H56NO6P 53.9 0.00 0.62 0.47
DHA 327.2319 12.09 M - H C22H32O2 41.3 0.00 0.54 0.38
LysoPE(P-18:0) 464.3146 12.31 M - H, 2M - H C23H48NO6P 41.4 0.00 0.55 0.32
PS(19:1/22:6) 846.5325 14.16 M - H C47H78NO10P 53.7 0.00 0.49 0.15
PC(20:5/22:6) 896.5469 14.34 M + FA - H C50H78NO8P 48.1 0.00 0.46 0.18
PC(22:6/18:3) 872.5463 14.42 M + FA - H C48H78NO8P 48.5 0.00 0.46 0.19
PC(16:1/18:3) 798.5292 14.45 M + FA - H C42H76NO8P 58.2 0.00 0.64 0.20
PE(19:1/22:6) 848.5476 14.55 M + FA - H C46H78NO8P 47.8 0.00 0.47 0.15
PE(17:1/22:4) 824.5467 14.61 M + FA - H C44H78NO8P 57.1 0.00 0.78 0.29
7-Ketodeoxycholic acid 811.5309 14.63 2M - H C24H38O5 42.3 0.00 0.72 0.39
PE(15:0/22:4) 798.5303 14.68 M + FA - H C42H76NO8P 49.9 0.00 0.58 0.20
PE(18:0/20:4) 782.5346 14.69 M - H C43H78NO9P 45.5 0.00 0.40 0.10
PC(15:0/17:2) 774.5305 14.74 M + FA - H C40H76NO8P 44.6 0.00 0.78 0.37
PC(18:2/22:6) 874.563 14.79 M + FA - H C48H80NO8P 55.8 0.00 0.49 0.17
PE(20:2/22:6) 814.5347 14.79 M - H C47H78NO8P 46.9 0.00 0.62 0.34
PE-Cer(22:0/d14:1) 733.5504 14.88 M + FA - H C38H77N2O6P 54.3 0.00 1.74 2.20
PE(19:0/20:5) 824.5472 14.91 M + FA - H C44H78NO8P 46.7 0.00 0.90 0.55
PE(16:0/20:2) 788.5402 15.06 M + FA - H C41H78NO8P 43.6 0.00 0.89 0.63
PE(20:0/20:5) 838.5614 15.13 M + FA - H C45H80NO8P 45.9 0.00 0.66 0.34
PE(16:0/20:5) 736.4937 15.13 M - H C41H72NO8P 43.3 0.00 0.66 0.28
PC(18:1/20:5) 850.5626 15.17 M + FA - H C46H80NO8P 53.8 0.00 0.67 0.33
PE(P-16:0/22:6) 762.5101 15.21 M - H C43H74NO8P 51.2 0.00 0.70 0.31
PE-Cer(21:0/d16:1) 747.567 15.3 M + FA - H C39H79N2O6P 50.7 0.00 2.17 3.19
PC(O-16:0/20:5) 810.5667 15.35 M + FA - H C44H80NO7P 55.5 0.00 0.67 0.30
PS(19:0/22:4) 852.5772 15.37 M - H C47H84NO10P 57.6 0.00 0.68 0.43
PE(P-16:0/20:5) 720.4974 15.54 M - H C41H72NO7P 54.4 0.00 1.01 0.61
PC(18:0/20:5) 852.5777 15.64 M + FA - H C46H82NO8P 50.1 0.00 0.79 0.50
PC(P-18:1/20:4) 836.5818 15.67 M + FA - H C46H82NO7P 53.5 0.00 0.66 0.34
PC(O-16:0/22:5) 838.5968 15.9 M + FA - H C46H84NO7P 49.5 0.00 0.59 0.27
GPEtn(18:0/20:5) 764.5247 15.92 M - H C43H76NO8P 40.5 0.00 0.89 0.51
PI(15:0/22:0) 879.5952 15.95 M - H C46H89O13P 53.2 0.00 0.68 0.43
PS(21:0/20:4) 898.5784 16.17 M + FA - H C47H84NO10P 53.1 0.00 1.73 2.69
PC(18:0/22:5) 880.608 16.23 M + FA - H C48H86NO8P 47.2 0.00 0.61 0.37
PC(O-16:0/22:5) 838.5971 16.23 M + FA - H C46H84NO7P 45.3 0.00 0.58 0.34
cholestan-oic acid 913.6015 16.37 2M + FA - H C26H42O5 43.6 0.00 1.40 1.98
PE(21:0/20:3) 856.6073 16.38 M + FA - H C46H86NO8P 55.7 0.00 0.83 0.62
PE(16:0/18:1) 716.5243 16.41 M - H C39H76NO8P 57.5 0.00 1.76 1.90
PC(P-18:1/22:5) 862.5921 16.44 M + FA - H C48H84NO7P 49 0.00 0.55 0.42
PE(P-18:0/20:5) 748.533 16.46 M - H C43H76NO7P 55.6 0.00 0.97 0.65
Lactosylceramide (16:0/d18:1) 906.6074 16.55 M + FA - H C46H87NO13 40.8 0.00 0.64 0.44
PE(18:0/20:1) 818.5904 16.57 M + FA - H C43H84NO8P 40.8 0.00 1.44 1.64
PS(21:0/22:4) 880.6069 16.59 M - H C49H88NO10P 40.8 0.00 0.70 0.51
PC(O-18:0/22:6) 864.611 16.61 M + FA - H C48H86NO7P 53.2 0.00 0.44 0.20
DG(18:1/20:5/0:0) 685.5027 16.84 M + FA - H C41H68O5 47.5 0.02 0.60 0.38
PE(P-18:0/22:6) 774.5461 16.86 M - H C45H78NO7P 52.3 0.03 0.98 0.66
PE(P-18:0/20:4) 750.5435 17.18 M - H C43H78NO7P 53.4 0.00 1.60 2.23
PC(P-18:0/20:2) 842.6296 17.29 M + FA - H C46H88NO7P 52.3 0.00 1.39 1.67
PE(18:1/18:0) 744.5521 17.55 M - H C41H80NO8P 42 0.00 2.21 3.09
PE(P-16:0/18:0) 702.543 17.59 M - H C39H78NO7P 47.5 0.00 1.80 2.86
PE(22:0/18:1) 846.6216 17.72 M + FA - H C45H88NO8P 48.1 0.01 1.62 1.61
PE(O-20:0/19:1) 818.6284 17.95 M + FA - H C44H88NO7P 51.9 0.00 2.29 2.86