Core 1 glycan structure

Loading ...
Loading ...
Loading ...
Loading ...
Loading ...
Loading ...

3D structure from GLYCAM

Cross-references

GlyTouCan : G60883HN

GlyGen : G60883HN

ChEBI : 152247


Composition

Hex:2 HexNAc:1 dHex:1


IUPAC

Fuc(a1-2)[Gal(a1-4)]Gal(b1-3)GalNAc

GlycoCT

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

GWS

freeEnd--?a1D-GalNAc,p--3b1D-Gal,p(--2a1L-Fuc,p)--4a1D-Gal,p$MONO,Und,0,0,freeEnd

Glycam

DGalpa1-4[LFucpa1-2]DGalpb1-3DGalpNAca1-OH

SMILES

C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2[C@H]([C@H]([C@H](O[C@H]2O[C@@H]3[C@H]([C@H](O[C@@H]([C@@H]3O)CO)O)NC(=O)C)CO)O[C@@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)O)O)O)O

InCHI key

MIHPVNXUYJDDGV-DJDWDHCXSA-N

InCHI

InChI=1S/C26H45NO20/c1-6-12(32)15(35)17(37)24(41-6)47-22-19(39)20(45-25-18(38)16(36)13(33)8(3-28)43-25)10(5-30)44-26(22)46-21-11(27-7(2)31)23(40)42-9(4-29)14(21)34/h6,8-26,28-30,32-40H,3-5H2,1-2H3,(H,27,31)/t6-,8+,9+,10+,11+,12+,13-,14-,15+,16-,17-,18+,19-,20-,21+,22+,23-,24-,25+,26-/m0/s1