No-core glycan structure

Cross-references

GlyTouCan : G92311HB

GlyGen : G92311HB

ChEBI : 155326

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Composition

Hex:2 HexNAc:3 dHex:1

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IUPAC

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

GlycoCT

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

GWS

freeEnd--?b1D-GlcNAc,p(--3a1L-Fuc,p)--4b1D-GlcNAc,p--4b1Man--6a1Man--2b1D-GlcNAc,p$MONO,Und,0,0,freeEnd

Glycam

DGlcpNAcb1-2DManpa1-6DManpb1-4DGlcpNAcb1-4[LFucpa1-3]DGlcpNAcb1-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[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[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)NC(=O)C)O)O)O)O)NC(=O)C)CO)O)NC(=O)C)O)O)O

InCHI key

LQVOTESNSUCYBX-ZLZWNYCKSA-N

InCHI

InChI=1S/C42H71N3O30/c1-10-22(53)28(59)31(62)40(66-10)74-35-21(45-13(4)52)37(64)67-17(8-49)34(35)73-39-20(44-12(3)51)27(58)33(16(7-48)70-39)72-41-32(63)29(60)25(56)18(71-41)9-65-42-36(30(61)24(55)15(6-47)69-42)75-38-19(43-11(2)50)26(57)23(54)14(5-46)68-38/h10,14-42,46-49,53-64H,5-9H2,1-4H3,(H,43,50)(H,44,51)(H,45,52)/t10-,14+,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