GlyConnect

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taxonomy (1) protein (0) source (3) structure (1) composition (1) disease (1) reference (11) site (0) peptide (0)

Taxonomy

Homo sapiens (Human)

Protein

Source

Reported structure

Free / Lactose / NeuAc(a2-3)Gal(b1-4)Glc

Composition

Hex:2 NeuAc:1 (avg mass : 633.558 )

Disease

Kidney Failure, Chronic (DOID:784)

Reference

Impact of maternal characteristics on human milk oligosaccharide composition over the first 4 months of lactation in a cohort of healthy European mothers (2019 - Tinu Mary Samuel, Aristea Binia, Carlos Antonio de Castro, Sagar K. Thakkar, Claude Billeaud, Massimo Agosti, Isam Al-Jashi, Maria Jose Costeira, Giovanna Marchini, Cecilia Martínez-Costa, Jean-Charles Picaud, Tom Stiris, Silvia-Maria Stoicescu, Mireille Vanpeé, Magnus Domellöf, Sean Austin & Norbert Sprenger) / Status : Reviewed
Creating a Mass Spectral Reference Library for Oligosaccharides in Human Milk (2018 - Connie A Remoroza, Tytus D Mak, Maria Lorna A De Leoz, Yuri A Mirokhin, Stephen E Stein) / Status : Reviewed
Human milk oligosaccharides as essential tools for basic and application studies on galectins (2018 - Tadasu Urashima, Jun Hirabayashi, Sachiko Sato, Akira Kobata) / Status : Reviewed
Synthesis of Asymmetrical Multiantennary Human Milk Oligosaccharides (2017 - Anthony R Prudden, Lin Liu, Chantelle J Capicciotti, Margreet A Wolfert, Shuo Wang, Zhongwei Gao, Lu Meng, Kelley W Moremen, Geert-Jan Boons) / Status : Reviewed
Systematic Review of the Concentrations of Oligosaccharides in Human Milk (2017 - Stephan Thurl, Manfred Munzert, Günther Boehm, Catherine Matthews, Bernd Stahl) / Status : Reviewed
Human Milk Oligosaccharides (HMOS): Structure, Function, and Enzyme-Catalyzed Synthesis (2015 - Xi Chen) / Status : Reviewed
Annotation and Structural Analysis of Sialylated Human Milk Oligosaccharides (2011 - Shuai Wu, Rudolf Grimm, J Bruce German, Carlito B Lebrilla) / Status : Reviewed
High-performance capillary electrophoresis of sialylated oligosaccharides of human milk. (2000 - Shen Z, Warren C, Newburg D) / Status : Reviewed
Isolation of sialylcompounds from hemofiltrate of chronic uremic patients and identification by nuclear magnetic resonance. (1987 - Weisshaar G, Brunner H, Friebolin H, Baumann W, Mann H, Opferkuch H, Sieberth H) / Status : Reviewed
Isolation and structural characterization of five major sialyloligosaccharides and a sialylglycopeptide from normal human urine. (1983 - Parkkinen J, Finne J) / Status : Reviewed
Fractionation of sialyl oligosaccharides of human milk by ion-exchange chromatography (1978 - David F. Smith, David A. Zorf, Victor Ginsburg) / Status : Reviewed

Reported glycosite

Mass spectrometry observed peptide

- Free / Lactose (avg mass : 633.558)

3D structure from GLYCAM

Cross-references

GlyTouCan : G56516VH

GlyGen : G56516VH

ChEBI : 151472

Glycologue : [S3L4G]

Composition

IUPAC

NeuAc(a2-3)Gal(b1-4)Glc

GlycoCT

RES
1b:x-dglc-HEX-1:5
2b:b-dgal-HEX-1:5
3b:a-dgro-dgal-NON-2:6|1:a|2:keto|3:d
4s:n-acetyl
LIN
1:1o(4+1)2d
2:2o(3+2)3d
3:3d(5+1)4n

GWS

freeEnd--??1D-Glc,p--4b1D-Gal,p--3a2D-NeuAc,p$MONO,Und,0,0,freeEnd

SMILES

CC(=O)N[C@@H]1[C@H](C[C@@](O[C@H]1[C@@H]([C@@H](CO)O)O)(C(=O)O)O[C@H]2[C@H]([C@H](O[C@H]([C@@H]2O)O[C@@H]3[C@H](OC([C@@H]([C@H]3O)O)O)CO)CO)O)O

InCHI key

CILYIEBUXJIHCO-METZQCMUSA-N

InCHI

InChI=1S/C23H39NO19/c1-6(28)24-11-7(29)2-23(22(37)38,42-18(11)12(31)8(30)3-25)43-19-13(32)9(4-26)40-21(16(19)35)41-17-10(5-27)39-20(36)15(34)14(17)33/h7-21,25-27,29-36H,2-5H2,1H3,(H,24,28)(H,37,38)/t7-,8+,9+,10+,11+,12+,13-,14+,15+,16+,17+,18+,19-,20?,21-,23-/m0/s1