Core 4 glycan structure

Cross-references

GlyTouCan : G21412CQ

GlyGen : G21412CQ

ChEBI : 148348

UniCarb-DB :

• 461
• 2779

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Composition

Hex:1 HexNAc:3

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IUPAC

Gal(b1-4)GlcNAc(b1-6)[GlcNAc(b1-3)]GalNAc

GlycoCT

RES
1b:a-dgal-HEX-1:5
2s:n-acetyl
3b:b-dglc-HEX-1:5
4s:n-acetyl
5b:b-dglc-HEX-1:5
6s:n-acetyl
7b:b-dgal-HEX-1:5
LIN
1:1d(2+1)2n
2:1o(3+1)3d
3:3d(2+1)4n
4:1o(6+1)5d
5:5d(2+1)6n
6:5o(4+1)7d

GWS

freeEnd--?a1D-GalNAc,p(--3b1D-GlcNAc,p)--6b1D-GlcNAc,p--4b1D-Gal,p$MONO,Und,0,0,freeEnd

Glycam

DGlcpNAcb1-3[DGalpb1-4DGlcpNAcb1-6]DGalpNAca1-OH

SMILES

CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@@H]2[C@H]([C@H](O[C@@H]([C@@H]2O)CO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)O)NC(=O)C)O)NC(=O)C)CO)O)O

InCHI key

AUOTWAKAURVMAG-VPFLZUPKSA-N

InCHI

InChI=1S/C30H51N3O21/c1-8(37)31-15-21(43)18(40)11(4-34)50-29(15)54-26-17(33-10(3)39)27(47)49-14(20(26)42)7-48-28-16(32-9(2)38)22(44)25(13(6-36)52-28)53-30-24(46)23(45)19(41)12(5-35)51-30/h11-30,34-36,40-47H,4-7H2,1-3H3,(H,31,37)(H,32,38)(H,33,39)/t11-,12-,13-,14-,15-,16-,17-,18-,19+,20+,21-,22-,23+,24-,25-,26-,27+,28-,29+,30+/m1/s1