Core 2 glycan structure

Cross-references

GlyTouCan : G13292XY

GlyGen : G13292XY

ChEBI : 148071

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Composition

Hex:3 HexNAc:4 dHex:1

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IUPAC

GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-3)Gal(b1-3)[Fuc(a1-2)Gal(b1-4)GlcNAc(b1-6)]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:b-dgal-HEX-1:5
7b:b-dglc-HEX-1:5
8s:n-acetyl
9b:b-dglc-HEX-1:5
10s:n-acetyl
11b:b-dgal-HEX-1:5
12b:a-lgal-HEX-1:5|6:d
LIN
1:1d(2+1)2n
2:1o(3+1)3d
3:3o(3+1)4d
4:4d(2+1)5n
5:4o(4+1)6d
6:6o(3+1)7d
7:7d(2+1)8n
8:1o(6+1)9d
9:9d(2+1)10n
10:9o(4+1)11d
11:11o(2+1)12d

GWS

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

Glycam

DGlcpNAcb1-3DGalpb1-4DGlcpNAcb1-3DGalpb1-3[LFucpa1-2DGalpb1-4DGlcpNAcb1-6]DGalpNAca1-OH

SMILES

C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2[C@H]([C@H]([C@H](O[C@H]2O[C@@H]3[C@H](O[C@H]([C@@H]([C@H]3O)NC(=O)C)OC[C@@H]4[C@@H]([C@@H]([C@H]([C@H](O4)O)NC(=O)C)O[C@H]5[C@@H]([C@H]([C@H]([C@H](O5)CO)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O[C@H]7[C@@H]([C@H]([C@H]([C@H](O7)CO)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)NC(=O)C)O)O)NC(=O)C)O)O)CO)CO)O)O)O)O)O

InCHI key

QSLYRZFUVNTKDG-SBDOWDELSA-N

InCHI

InChI=1S/C56H94N4O40/c1-13-29(71)38(80)40(82)53(87-13)100-48-39(81)31(73)19(7-62)92-56(48)96-44-22(10-65)93-50(26(36(44)78)58-15(3)68)86-12-24-34(76)45(28(49(85)88-24)60-17(5)70)97-55-42(84)47(33(75)21(9-64)91-55)99-52-27(59-16(4)69)37(79)43(23(11-66)94-52)95-54-41(83)46(32(74)20(8-63)90-54)98-51-25(57-14(2)67)35(77)30(72)18(6-61)89-51/h13,18-56,61-66,71-85H,6-12H2,1-5H3,(H,57,67)(H,58,68)(H,59,69)(H,60,70)/t13-,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+,49-,50+,51-,52-,53-,54-,55-,56-/m0/s1