Structure

Cross-references

GlyTouCan : G72338UH

GlyGen : G72338UH

ChEBI : 153315

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Composition

Hex:2 HexNAc:3

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IUPAC

GalNAc(b1-4)GalNAc(b1-3)Gal(b1-4)Gal(b1-3)GalNAc

GlycoCT

RES
1b:a-dgal-HEX-1:5
2s:n-acetyl
3b:b-dgal-HEX-1:5
4b:b-dgal-HEX-1:5
5b:b-dgal-HEX-1:5
6s:n-acetyl
7b:b-dgal-HEX-1:5
8s:n-acetyl
LIN
1:1d(2+1)2n
2:1o(3+1)3d
3:3o(4+1)4d
4:4o(3+1)5d
5:5d(2+1)6n
6:5o(4+1)7d
7:7d(2+1)8n

GWS

freeEnd--?a1D-GalNAc,p--3b1D-Gal,p--4b1D-Gal,p--3b1D-GalNAc,p--4b1D-GalNAc,p$MONO,Und,0,0,freeEnd

Glycam

DGalpNAcb1-4DGalpNAcb1-3DGalpb1-4DGalpb1-3DGalpNAca1-OH

SMILES

CC(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@H]1O[C@H]2[C@H](O[C@H]([C@@H]([C@H]2O)NC(=O)C)O[C@H]3[C@H]([C@H](O[C@H]([C@@H]3O)O[C@H]4[C@H](O[C@H]([C@@H]([C@H]4O)O)O[C@@H]5[C@H]([C@H](O[C@@H]([C@@H]5O)CO)O)NC(=O)C)CO)CO)O)CO)CO)O)O

InCHI key

QFUJDOOWJAFZJG-WNRJUCCUSA-N

InCHI

InChI=1S/C36H61N3O26/c1-9(45)37-17-23(51)20(48)12(4-40)58-33(17)62-28-15(7-43)60-34(18(24(28)52)38-10(2)46)65-31-22(50)14(6-42)59-36(27(31)55)63-29-16(8-44)61-35(26(54)25(29)53)64-30-19(39-11(3)47)32(56)57-13(5-41)21(30)49/h12-36,40-44,48-56H,4-8H2,1-3H3,(H,37,45)(H,38,46)(H,39,47)/t12-,13-,14-,15-,16-,17-,18-,19-,20+,21+,22+,23-,24-,25-,26-,27-,28+,29+,30-,31+,32+,33+,34+,35+,36+/m1/s1