MIRAGE upload

redEnd--??1D-GalNAc,p(--3b1D-Gal,p)--6a2D-NeuAc,p$MONO,Und,-H,0,redEnd

An E-workflow for implementing guidelines in glycomics mass spectrometry

GlyTouCan Accession Number: Loading...

Peak	Intensity
195.92	0.6
204.13	1.2
Annotations: YZ ZY
219.85	0.5
236.05	0.4
272.08	0.5
289.64	1.3
Annotations: B
290.1	39.0
Annotations: B
291.07	5.2
307.71	0.8
Annotations: C
366.15	0.6
Annotations: Z
384.16	3.3
Annotations: Y
433.06	1.3
436.41	1.3
453.8	1.5
Annotations: ^{0,2}X_{NeuAc}
454.22	2.0
Annotations: ^{0,2}X_{NeuAc}
455.1	0.7
469.13	2.2
Annotations: Y^{1,3}X_{NeuAc}
470.38	1.7
Annotations: ^{2,5}X_{NeuAc}
471.3	0.7
477.28	0.7
480.15	1.1
495.85	0.8
507.15	1.8
507.47	1.6
514.31	1.7
556.83	0.5
567.18	0.8
583.52	1.6
597.03	5.9
597.3	5.5
598.27	1.1
605.54	2.3
606.26	0.7
615.27	15.1
Annotations: ^{0,4}X_{Gal} ^{1,3}X_{Gal} ^{2,4}X_{Gal}
616.14	7.6
616.48	0.9
627.77	0.5
Annotations: ^{1,5}A_{GalNAc}
631.06	1.6
Annotations: ^{1,3}X_{NeuAc}
638.8	0.6
639.09	0.9
644.41	2.2

There are 77 similar spectra:

Id	Structure	Score
		0.97
4801		0.97
4078		0.97
3746		0.97
6707		0.96
7620		0.96
		0.96
7681		0.96
7688		0.96
5550		0.96
7140		0.96
7180		0.96
7391		0.96
7420		0.96
3871		0.96
		0.95
6583		0.95
6797		0.95
7982		0.95
3492		0.95
		0.95
5422		0.95
7164		0.95
5510		0.95
5700		0.95
7236		0.94
4202		0.94
		0.93
7693		0.93
3636		0.93
7181		0.91
7141		0.90
7392		0.90
7421		0.90
4232		0.90
5224		0.90
7983		0.89
		0.89
6584		0.89
		0.89
7694		0.89
		0.89
7682		0.89
7689		0.89
5423		0.89
7984		0.89
5551		0.89
3747		0.89
7165		0.89
4203		0.89
3972		0.89
5511		0.89
		0.89
5389		0.89
7621		0.89
6798		0.89
4233		0.89
5225		0.89
4079		0.89
3872		0.89
		0.89
		0.89
7649		0.89
7665		0.89
5701		0.89
		0.89
4802		0.89
3493		0.88
6708		0.88
5198		0.88
3637		0.88
7237		0.88
5188		0.88
5182		0.83
3971		0.81
7880		0.62
5197		0.51

Structure Format

SNFG Oxford Text

Structure details

Reducing Mass: 674.25
(Calculated Monoisotopic)

Reducing End: Reduced

Persubstitution: Underivatised

Biological Context

Taxonomy - Bos Taurus

Tissue - Cervix Mucus

HPLC

Column NA

Method

78 min gradient with Approx 3-5 ul/min (static split from 250 ul/min) run rate
10 mM (NH4)HCO3
10 mM (NH4)HCO3 in 80% acetonitrile

Mass Spec

Thermo Fisher LTQ Linear Ion Trap ESI

MIRAGE Structural data

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