MIRAGE upload

redEnd--?a1D-GalNAc,p(--3b1D-Gal,p)--6b1D-GlcNAc,p--4b1D-Gal,p--3a2D-NeuAc,p$MONO,Und,-H,0,redEnd

Colorectal cancer cell lines show striking isomeric diversity of their O-glycome

GlyTouCan Accession Number: Loading...

Peak	Intensity
290.121	9126.0
347.187	2109.0
364.152	2806.0
384.169	2713.0
389.147	14660.0
389.347	1296.0
407.167	16571.0
407.309	1535.0
425.148	1363.0
509.221	3779.0
521.231	1656.0
527.244	11424.0
558.052	26.0
569.224	70659.0
569.229	86963.0
587.247	39753.0
627.256	2509.0
635.007	3498.0
651.229	43.0
652.229	399.0
697.27	1525.0
707.292	5064.0
714.22	1454.0
727.226	2450.0
731.316	6369.0
741.177	135.0
745.254	8700.0
749.301	119483.0
749.675	2237.0
782.249	4682.0
816.342	2320.0
819.329	4270.0
842.319	12926.0
854.339	202.0
920.187	2497.0
932.394	1777.0
936.385	1705.0
942.969	2820.0
951.407	1213.0
952.294	111.0
954.102	1639.0
962.349	116501.0
962.572	3199.0
976.846	1925.0
978.345	3234.0
980.358	39275.0
982.225	2946.0
991.377	2018.0
994.263	3265.0
996.356	2798.0
1001.789	2284.0
1004.332	6101.0
1006.037	2916.0
1020.249	7638.0
1023.382	21987.0
1028.825	4525.0
1474.344	245.0

There are 49 similar spectra:

Id	Structure	Score
3511		0.92
5449		0.89
		0.88
6594		0.88
3138		0.87
5191		0.86
		0.84
6593		0.84
8027		0.83
4249		0.83
5241		0.83
3510		0.81
5590		0.81
5179		0.80
3981		0.80
5448		0.78
4085		0.78
4248		0.78
5240		0.78
3980		0.78
5739		0.76
3766		0.76
		0.75
4877		0.75
8026		0.73
7229		0.72
7413		0.71
7442		0.71
7228		0.71
		0.70
3894		0.70
4212		0.68
		0.68
		0.68
5184		0.67
5210		0.66
		0.65
		0.65
4250		0.65
5242		0.65
8028		0.65
5186		0.64
5740		0.62
5741		0.61
8025		0.61
5803		0.60
7632		0.58
5212		0.55
5805		0.52

Structure Format

SNFG Oxford Text

Structure details

Reducing Mass: 1039.39
(Calculated Monoisotopic)

Reducing End: Reduced

Persubstitution: Underivatised

Biological Context

Taxonomy - Homo Sapiens

Tissue - Cell Line

HPLC

Column Hypercarb

Method

73 min gradient with 0,6ul/min run rate
10mM ammonium bicarbonate
60% ACN, 10mM ammonium bicarbonate

Mass Spec

Bruker Daltonik amaZon Speed ETD ETD

MIRAGE Structural data

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