High-Mannose glycan structure

Loading ...
Loading ...
Loading ...
Loading ...
Loading ...
structure 142
N-Linked / High-Mannose (avg mass : 1721.5445)

3D structure from GLYCAM

Cross-references

GlyTouCan : G41824PC

GlyGen : G41824PC

ChEBI : 150520


Composition

Hex:8 HexNAc:2


IUPAC

Glc(a1-2)Glc(a1-3)Glc(a1-3)Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-6)]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:a-dman-HEX-1:5
8b:a-dman-HEX-1:5
9b:a-dglc-HEX-1:5
10b:a-dglc-HEX-1:5
11b:a-dglc-HEX-1:5
12b: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
7:7o(2+1)8d
8:8o(3+1)9d
9:9o(3+1)10d
10:10o(2+1)11d
11:5o(6+1)12d

GWS

freeEnd--?b1D-GlcNAc,p--4b1D-GlcNAc,p--4b1Man(--3a1Man--2a1Man--2a1Man--3a1Glc--3a1Glc--2a1Glc)--6a1Man$MONO,Und,0,0,freeEnd

Glycam

DGlcpa1-2DGlcpa1-3DGlcpa1-3DManpa1-2DManpa1-2DManpa1-3[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)O)O)O)O)O[C@@H]5[C@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O[C@@H]6[C@H]([C@H]([C@@H]([C@H](O6)CO)O)O)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[C@@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)O)O)NC(=O)C)O

InCHI key

AECVBPKATGHPIN-WHDAONAKSA-N

InCHI

InChI=1S/C64H108N2O51/c1-13(76)65-25-35(86)47(22(10-74)100-55(25)98)110-56-26(66-14(2)77)36(87)48(23(11-75)108-56)111-61-46(97)51(34(85)24(109-61)12-99-57-42(93)37(88)27(78)15(3-67)101-57)114-63-54(41(92)31(82)18(6-70)106-63)117-64-53(40(91)30(81)19(7-71)107-64)116-60-44(95)49(32(83)20(8-72)104-60)112-59-45(96)50(33(84)21(9-73)103-59)113-62-52(39(90)29(80)17(5-69)105-62)115-58-43(94)38(89)28(79)16(4-68)102-58/h15-64,67-75,78-98H,3-12H2,1-2H3,(H,65,76)(H,66,77)/t15-,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-,49+,50+,51+,52-,53+,54+,55-,56+,57+,58-,59-,60-,61+,62-,63-,64-/m1/s1