Core 1 glycan structure

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3D structure from GLYCAM

Cross-references

GlyTouCan : G68200GL

GlyGen : G68200GL

ChEBI : 153077


Composition

Hex:2 HexNAc:1 dHex:2


IUPAC

Fuc(a1-2)Gal(b1-3)[Fuc(a1-2)]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:b-dgal-HEX-1:5
6b:a-lgal-HEX-1:5|6:d
LIN
1:1d(2+1)2n
2:1o(3+1)3d
3:3o(2+1)4d
4:3o(3+1)5d
5:5o(2+1)6d

GWS

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

Glycam

LFucpa1-2DGalpb1-3[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[C@H]4[C@H]([C@@H]([C@@H]([C@@H](O4)C)O)O)O)O[C@@H]5[C@H]([C@H](O[C@@H]([C@@H]5O)CO)O)NC(=O)C)CO)O)CO)O)O)O)O)O

InCHI key

BWNLZBFZZYIBTK-QXFPMROESA-N

InCHI

InChI=1S/C32H55NO24/c1-7-14(38)19(43)22(46)29(49-7)56-26-21(45)16(40)10(4-34)52-31(26)55-25-18(42)12(6-36)53-32(27(25)57-30-23(47)20(44)15(39)8(2)50-30)54-24-13(33-9(3)37)28(48)51-11(5-35)17(24)41/h7-8,10-32,34-36,38-48H,4-6H2,1-3H3,(H,33,37)/t7-,8-,10+,11+,12+,13+,14+,15+,16-,17-,18-,19+,20+,21-,22-,23-,24+,25-,26+,27+,28-,29-,30-,31-,32-/m0/s1