Core 2 glycan structure

Cross-references

GlyTouCan : G70783BY

GlyGen : G70783BY

ChEBI : 153543

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Composition

Hex:3 HexNAc:3 dHex:1

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IUPAC

Gal(b1-3)GlcNAc(b1-3)Gal(b1-4)[Fuc(a1-3)]GlcNAc(b1-6)[Gal(b1-3)]GalNAc

GlycoCT

RES
1b:a-dgal-HEX-1:5
2s:n-acetyl
3b:b-dgal-HEX-1:5
4b:b-dglc-HEX-1:5
5s:n-acetyl
6b:a-lgal-HEX-1:5|6:d
7b:b-dgal-HEX-1:5
8b:b-dglc-HEX-1:5
9s:n-acetyl
10b:b-dgal-HEX-1:5
LIN
1:1d(2+1)2n
2:1o(3+1)3d
3:1o(6+1)4d
4:4d(2+1)5n
5:4o(3+1)6d
6:4o(4+1)7d
7:7o(3+1)8d
8:8d(2+1)9n
9:8o(3+1)10d

GWS

freeEnd--?a1D-GalNAc,p(--3b1D-Gal,p)--6b1D-GlcNAc,p(--3a1L-Fuc,p)--4b1D-Gal,p--3b1D-GlcNAc,p--3b1D-Gal,p$MONO,Und,0,0,freeEnd

Glycam

DGalpb1-3[DGalpb1-3DGlcpNAcb1-3DGalpb1-4[LFucpa1-3]DGlcpNAcb1-6]DGalpNAca1-OH

SMILES

C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](O[C@@H]([C@H]2O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O[C@H]5[C@@H]([C@H]([C@H]([C@H](O5)CO)O)O)O)NC(=O)C)O)CO)OC[C@@H]6[C@@H]([C@@H]([C@H]([C@H](O6)O)NC(=O)C)O[C@H]7[C@@H]([C@H]([C@H]([C@H](O7)CO)O)O)O)O)NC(=O)C)O)O)O

InCHI key

KYDLWVCSHGJWCH-PDIURYPSSA-N

InCHI

InChI=1S/C48H81N3O35/c1-11-24(60)30(66)33(69)45(75-11)85-40-23(51-14(4)59)43(74-10-20-29(65)38(21(42(73)76-20)49-12(2)57)83-46-34(70)31(67)25(61)15(5-52)78-46)81-19(9-56)37(40)82-48-36(72)41(28(64)18(8-55)80-48)86-44-22(50-13(3)58)39(27(63)17(7-54)77-44)84-47-35(71)32(68)26(62)16(6-53)79-47/h11,15-48,52-56,60-73H,5-10H2,1-4H3,(H,49,57)(H,50,58)(H,51,59)/t11-,15+,16+,17+,18+,19+,20+,21+,22+,23+,24+,25-,26-,27+,28-,29-,30+,31-,32-,33-,34+,35+,36+,37+,38+,39+,40+,41-,42-,43+,44-,45-,46-,47-,48-/m0/s1