Hybrid glycan structure

Cross-references

GlyTouCan : G56748EO

GlyGen : G56748EO

ChEBI : 151513

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Composition

Hex:5 HexNAc:5

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IUPAC

GlcNAc(b1-2)[GlcNAc(b1-4)]Man(a1-3)[Man(a1-3)[Man(a1-6)]Man(a1-6)][GlcNAc(b1-4)]Man(b1-4)GlcNAc(b1-4)GlcNAc

GlycoCT

RES
1b:b-dglc-HEX-1:5
2s:n-acetyl
3b:b-dglc-HEX-1:5
4s:n-acetyl
5b:b-dman-HEX-1:5
6b:a-dman-HEX-1:5
7b:b-dglc-HEX-1:5
8s:n-acetyl
9b:b-dglc-HEX-1:5
10s:n-acetyl
11b:b-dglc-HEX-1:5
12s:n-acetyl
13b:a-dman-HEX-1:5
14b:a-dman-HEX-1:5
15b:a-dman-HEX-1:5
LIN
1:1d(2+1)2n
2:1o(4+1)3d
3:3d(2+1)4n
4:3o(4+1)5d
5:5o(3+1)6d
6:6o(2+1)7d
7:7d(2+1)8n
8:6o(4+1)9d
9:9d(2+1)10n
10:5o(4+1)11d
11:11d(2+1)12n
12:5o(6+1)13d
13:13o(3+1)14d
14:13o(6+1)15d

GWS

freeEnd--?b1D-GlcNAc,p--4b1D-GlcNAc,p--4b1Man((--3a1Man(--2b1D-GlcNAc,p)--4b1D-GlcNAc,p)--4b1D-GlcNAc,p)--6a1Man(--3a1Man)--6a1Man$MONO,Und,0,0,freeEnd

Glycam

DGlcpNAcb1-2[DGlcpNAcb1-4]DManpa1-3[DGlcpNAcb1-4][DManpa1-3[DManpa1-6]DManpa1-6]DManpb1-4DGlcpNAcb1-4DGlcpNAcb1-OH

SMILES

CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O)CO)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O[C@H]3[C@H]([C@H]([C@@H]([C@H](O3)CO[C@@H]4[C@H]([C@H]([C@@H]([C@H](O4)CO[C@@H]5[C@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O[C@@H]6[C@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)NC(=O)C)O[C@@H]8[C@H]([C@H]([C@@H]([C@H](O8)CO)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)NC(=O)C)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)NC(=O)C)O)O)NC(=O)C)O

InCHI key

OFGVCCPCUPAWDM-HWSLBTGZSA-N

InCHI

InChI=1S/C70H117N5O51/c1-16(84)71-31-45(98)54(26(11-81)110-61(31)107)120-65-35(75-20(5)88)46(99)55(27(12-82)116-65)122-69-53(106)59(125-70-60(126-64-34(74-19(4)87)44(97)38(91)23(8-78)113-64)51(104)56(28(13-83)117-70)121-62-32(72-17(2)85)42(95)36(89)21(6-76)111-62)57(123-63-33(73-18(3)86)43(96)37(90)22(7-77)112-63)30(119-69)15-109-67-52(105)58(124-68-50(103)48(101)40(93)25(10-80)115-68)41(94)29(118-67)14-108-66-49(102)47(100)39(92)24(9-79)114-66/h21-70,76-83,89-107H,6-15H2,1-5H3,(H,71,84)(H,72,85)(H,73,86)(H,74,87)(H,75,88)/t21-,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-,57-,58+,59-,60+,61-,62+,63+,64+,65+,66+,67+,68-,69+,70-/m1/s1