Core 2 glycan structure

Cross-references

GlyTouCan : G76104SB

GlyGen : G76104SB

ChEBI : 154233

---

Composition

Hex:1 HexNAc:2 NeuAc:1 Su:1

---

IUPAC

HSO3(-6)GlcNAc(b1-6)[NeuAc(a2-6)Gal(b1-3)]GalNAc

GlycoCT

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

GWS

freeEnd--?a1D-GalNAc,p(--3b1D-Gal,p--6a2D-NeuAc,p)--6b1D-GlcNAc,p--6?1S$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)OC[C@@H]2[C@@H]([C@@H]([C@H]([C@@H](O2)O[C@@H]3[C@H]([C@H](O[C@@H]([C@@H]3O)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)COS(=O)(=O)O)O)O)NC(=O)C)O)NC(=O)C)O)O)O)O

InCHI key

UEXSIYYNCCECNS-JXJUAIKDSA-N

InCHI

InChI=1S/C33H55N3O27S/c1-9(38)34-17-12(41)4-33(32(51)52,63-28(17)20(43)13(42)5-37)57-7-15-22(45)25(48)26(49)31(61-15)62-27-19(36-11(3)40)29(50)59-14(23(27)46)6-56-30-18(35-10(2)39)24(47)21(44)16(60-30)8-58-64(53,54)55/h12-31,37,41-50H,4-8H2,1-3H3,(H,34,38)(H,35,39)(H,36,40)(H,51,52)(H,53,54,55)/t12-,13+,14+,15+,16+,17+,18+,19+,20+,21+,22-,23-,24+,25-,26+,27+,28+,29-,30+,31-,33+/m0/s1