Structure

Cross-references

GlyTouCan : G08520NM

GlyGen : G08520NM

ChEBI : 146850

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Composition

Hex:5 HexNAc:3

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IUPAC

Man(a1-3)[Man(a1-6)]Man(a1-6)[GlcNAc(b1-2)Man(a1-3)]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:a-dman-HEX-1:5
10b:a-dman-HEX-1:5
11b: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
8:5o(6+1)9d
9:9o(3+1)10d
10:9o(6+1)11d

GWS

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

Glycam

DGlcpNAcb1-2DManpa1-3[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)O[C@@H]7[C@H]([C@H]([C@@H]([C@H](O7)CO)O)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

InCHI key

MRIXKRYHOZQBAW-ABMGQQJYSA-N

InCHI

InChI=1S/C54H91N3O41/c1-12(64)55-23-33(74)42(19(8-62)86-47(23)83)94-49-25(57-14(3)66)34(75)43(20(9-63)91-49)95-53-41(82)45(97-54-46(37(78)29(70)18(7-61)90-54)98-48-24(56-13(2)65)32(73)26(67)15(4-58)87-48)31(72)22(93-53)11-85-51-40(81)44(96-52-39(80)36(77)28(69)17(6-60)89-52)30(71)21(92-51)10-84-50-38(79)35(76)27(68)16(5-59)88-50/h15-54,58-63,67-83H,4-11H2,1-3H3,(H,55,64)(H,56,65)(H,57,66)/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-/m1/s1