Core 4 glycan structure

Cross-references

GlyTouCan : G26497EU

GlyGen : G26497EU

ChEBI : 148709

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Composition

Hex:1 HexNAc:3 dHex:2

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IUPAC

Fuc(a1-2)Gal(b1-4)[Fuc(a1-3)]GlcNAc(b1-6)[GlcNAc(b1-3)]GalNAc

GlycoCT

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

GWS

freeEnd--?a1D-GalNAc,p(--3b1D-GlcNAc,p)--6b1D-GlcNAc,p(--3a1L-Fuc,p)--4b1D-Gal,p--2a1L-Fuc,p$MONO,Und,0,0,freeEnd

Glycam

DGlcpNAcb1-3[LFucpa1-2DGalpb1-4[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)O[C@H]4[C@H]([C@@H]([C@@H]([C@@H](O4)C)O)O)O)CO)OC[C@@H]5[C@@H]([C@@H]([C@H]([C@H](O5)O)NC(=O)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)NC(=O)C)O)NC(=O)C)O)O)O

InCHI key

QUBXOQBXMYDSPU-XLRMLWDTSA-N

InCHI

InChI=1S/C42H71N3O29/c1-10-22(52)28(58)31(61)40(65-10)73-35-21(45-14(5)51)38(70-17(8-48)33(35)71-42-36(30(60)25(55)16(7-47)69-42)74-41-32(62)29(59)23(53)11(2)66-41)64-9-18-26(56)34(20(37(63)67-18)44-13(4)50)72-39-19(43-12(3)49)27(57)24(54)15(6-46)68-39/h10-11,15-42,46-48,52-63H,6-9H2,1-5H3,(H,43,49)(H,44,50)(H,45,51)/t10-,11-,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-/m0/s1