No-core glycan structure

Cross-references

GlyTouCan : G70158KQ

GlyGen : G70158KQ

ChEBI : 153424

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Composition

Hex:2 HexNAc:1

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IUPAC

GlcNAc(a1-2)Galf(a1-2)Gal

GlycoCT

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

GWS

freeEnd--?a1D-Gal,p--2a1D-Gal,f--2a1D-GlcNAc,p$MONO,Und,0,0,freeEnd

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]2O[C@@H]3[C@H]([C@H]([C@H](O[C@@H]3O)CO)O)O)[C@@H](CO)O)O)CO)O)O

InCHI key

HIANTICUONOIBZ-AZQIFWGRSA-N

InCHI

InChI=1S/C20H35NO16/c1-5(25)21-9-12(29)10(27)8(4-24)34-19(9)37-17-14(31)15(6(26)2-22)35-20(17)36-16-13(30)11(28)7(3-23)33-18(16)32/h6-20,22-24,26-32H,2-4H2,1H3,(H,21,25)/t6-,7-,8-,9-,10-,11+,12-,13+,14+,15+,16-,17-,18+,19-,20-/m1/s1