Structure

    redEnd--??1D-GalNAc,p--3b1D-Gal,p$MONO,Und,-H,0,redEnd

Stimulated saliva composition in patients with cancer of the head and neck region

GlyTouCan Accession Number: Loading...

Peak Intensity
111.94 0.9
112.93 6.8
113.69 0.6
114.03 1.5
118.38 0.3
119.08 1.0
119.36 0.4
124.09 0.2
124.84 0.6
126.09 5.2
126.95 0.3
128.19 0.2
128.75 0.4
130.92 4.1
131.67 0.3
138.0 10.2
138.69 0.2
142.44 0.2
143.0 7.0
143.81 0.3
155.31 0.5
155.99 52.8
156.9 2.3
161.02 9.1

Annotations:

B ?1D-GalNAc,p/#bcleavage--3b1D-Gal,p$MONO,Und,-H,0,redEnd
161.85 1.7
162.09 1.2
167.97 0.3
168.93 0.4
169.92 0.2
178.99 24.0

Annotations:

C ?1D-GalNAc,p/#ccleavage--3b1D-Gal,p$MONO,Und,-H,0,redEnd
180.07 1.4
181.17 0.2
183.78 0.4
185.21 0.2
186.21 0.3
199.49 0.4
199.88 1.0
202.12 0.3
204.04 146.3

Annotations:

Z redEnd--??1D-GalNAc,p--3b1D-Gal,p/#zcleavage$MONO,Und,-H,0,redEnd
205.11 11.8
207.02 0.4
213.15 0.4
222.19 4.7

Annotations:

Y redEnd--??1D-GalNAc,p--3b1D-Gal,p/#ycleavage$MONO,Und,-H,0,redEnd
222.94 0.6
223.21 0.5
233.96 0.4
234.2 0.3
239.2 0.3
245.8 1.0
249.02 0.3
249.93 0.3

Annotations:

^{1,5}X_{Gal} redEnd--??1D-GalNAc,p--3b1D-Gal,p/#xcleavage_1_5$MONO,Und,-H,0,redEnd
255.01 0.3
255.35 0.5
262.94 0.7
264.07 0.2

Annotations:

^{0,2}X_{Gal} redEnd--??1D-GalNAc,p--3b1D-Gal,p/#xcleavage_0_2$MONO,Und,-H,0,redEnd
264.71 0.6

Annotations:

^{2,5}A_{GalNAc} ?1D-GalNAc,p/#acleavage_2_5--3b1D-Gal,p$MONO,Und,-H,0,redEnd
268.81 0.3
275.28 0.5
276.09 7.0
277.03 0.3
277.28 0.4
283.95 0.3
287.01 0.2
289.17 0.2
290.85 0.2
292.1 0.5

Annotations:

^{1,4}A_{GalNAc} ?1D-GalNAc,p/#acleavage_1_4--3b1D-Gal,p$MONO,Und,-H,0,redEnd
293.07 0.6
294.25 0.3

Annotations:

^{0,3}X_{Gal} redEnd--??1D-GalNAc,p--3b1D-Gal,p/#xcleavage_0_3$MONO,Und,-H,0,redEnd ^{1,4}X_{Gal} redEnd--??1D-GalNAc,p--3b1D-Gal,p/#xcleavage_1_4$MONO,Und,-H,0,redEnd
294.9 1.2
295.15 0.3
300.15 0.5
303.53 0.3
310.72 0.2
311.47 0.2
312.84 0.9
316.28 0.6
320.03 4.3
321.08 0.3
322.02 21.5
323.0 1.2
324.21 4.1

Annotations:

^{0,4}X_{Gal} redEnd--??1D-GalNAc,p--3b1D-Gal,p/#xcleavage_0_4$MONO,Und,-H,0,redEnd ^{1,3}X_{Gal} redEnd--??1D-GalNAc,p--3b1D-Gal,p/#xcleavage_1_3$MONO,Und,-H,0,redEnd ^{2,4}X_{Gal} redEnd--??1D-GalNAc,p--3b1D-Gal,p/#xcleavage_2_4$MONO,Und,-H,0,redEnd
325.22 1.3
328.62 0.5
335.07 0.5
337.84 0.3
339.89 2.5
341.05 0.4
342.23 0.5
348.24 0.2
355.25 0.2
357.07 0.4
357.46 0.8

There are 35 similar spectra:

Id Structure Score

3104

1.00

3735

1.00

3864

1.00

7737

1.00

5533

0.99

7177

0.99

5408

0.98

5685

0.98

7646

0.98

7662

0.98

7388

0.98

7417

0.98

3487

0.98

4074

0.98

6439

0.98

6500

0.98

6508

0.98

6516

0.98

6574

0.98

5384

0.98

4201

0.98

4796

0.98

4257

0.98

5248

0.98

6440

0.98

6501

0.98

6509

0.98

6517

0.98

6575

0.98

5193

0.97

7618

0.97

6692

0.96

3105

0.93

7725

0.70

7234

0.54

Structure Format

SNFG Oxford Text

Structure details

Reducing Mass: 383.16
(Calculated Monoisotopic)

Reducing End: Reduced

Persubstitution: Underivatised

Biological Context

Taxonomy - Homo Sapiens
Tissue - Gastric Mucosa

HPLC

Column

Method

  • gradient with 10-20 ul/min run rate
  • 10 mM NH4HCO3
  • 10 mM NH4HCO3 in 80% AcCN

Mass Spec

Agilent 6310 Ion Trap LC/MS

MIRAGE Structural data

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