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. 2016 Sep 9;11(9):e0162824. doi: 10.1371/journal.pone.0162824

Table 1. Mass spectrometric data for selected 27 O-glycans obtained from human saliva.

UHPLC Peak Id Average GU (PROC) HILIC-UHPLC-ESI-MS
Composition Calculated [m/z]+ Registered [m/z]+ Probable structures
Hex (H) HexNAc (N) Fucose (F) Neu5Ac (S)
1 1.40 0 1 1 0 587.38 587.32 -
2 1.51 1 0 1 0 546.38 546.30 F-H-PROC
3 1.63 0 2 1 0 791.45 790.41 F-N-N-PROC
4 1.66 1 1 0 0 603.39 603.32 H-N-PROC
5 1.81 1 1 1 0 749.45 749.38 F-H-N-PROC
6 2.21 1 1 1 0 749.45 749.38 F-H-N-PROC
7 2.30 1 1 0 1 894.48 894.42 S-H-N-PROC
8 2.45 1 2 0 0 806.46 806.40 N-(H)-N-PROC
9 2.48 1 2 0 0 806.46 806.40 N-(H)-N-PROC
10 2.57 1 1 2 0 895.5 895.44 S-(S-H)-N-ROC
11 2.61 1 2 1 0 952.51 952.46 N-(S-H)-N-ROC
12 2.64 1 3 0 0 1010.53 ‎ 1009.48 H-N-(N)-N-ROC
13 2.82 1 2 1 0 952.51 952.46 N-(F)-H-N-ROC
14 2.87 2 2 0 0 969.5 968.46 -
15 2.98 1 1 0 1 894.48 894.42 S-(H)-N-PROC
16 3.05 1 3 1 0 1156.59 1155.54 S-H-N-(N)-N-PROC
17 3.28 2 2 0 0 968.52 968.46 H-(H-N)-N-PROC
18 3.41 1 2 2 0 1098.59 1098.52 N-(F)-H-(F)-N-PROC
19 3.69 3 1 0 0 927.1 927.43 -
20 3.73 2 2 1 0 1114.59 1114.51 H-N-(F-H)-N-PROC
21 3.78 2 2 1 0 1114.59 1114.51 H-N-(F-H)-N-PROC
22 3.85 2 2 0 1 1259.64 1259.55 S-H-N-H-N PROC
23 3.89 2 2 1 0 1114.59 1114.51 H-N-(F-H)-N-PROC
24 3.97 2 2 1 0 1114.58 1114.51 N-H-N-(F)-H-PROC
25 4.18 3 2 0 0 1130.58 1130.51 -
26 4.31 2 2 2 0 1260.65 1260.57 F-H-N-(F-H)-N-PROC
27 4.40 2 2 1 1 [703.00]2+ [703.31]2+ F-H-N-(S-H)-N-PROC