No-core glycan structure

Loading ...
Loading ...
Loading ...
Loading ...
Loading ...
Loading ...
Loading ...

3D structure from GLYCAM

Cross-references

GlyTouCan : G21290RB

GlyGen : G21290RB

ChEBI : 148334

UniCarb-DB :


Composition

HexNAc:2 dHex:1


IUPAC

Fuc(a1-6)[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:a-lgal-HEX-1:5|6:d
LIN
1:1d(2+1)2n
2:1o(4+1)3d
3:3d(2+1)4n
4:1o(6+1)5d

GWS

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

Glycam

DGlcpNAcb1-4[LFucpa1-6]DGlcpNAcb1-OH

SMILES

C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)O)NC(=O)C)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)NC(=O)C)O)O)O

InCHI key

YBYSAIOYCWNLAP-FGCCXTAMSA-N

InCHI

InChI=1S/C22H38N2O15/c1-6-13(28)17(32)18(33)22(36-6)35-5-10-19(16(31)11(20(34)37-10)23-7(2)26)39-21-12(24-8(3)27)15(30)14(29)9(4-25)38-21/h6,9-22,25,28-34H,4-5H2,1-3H3,(H,23,26)(H,24,27)/t6-,9+,10+,11+,12+,13+,14+,15+,16+,17+,18-,19+,20+,21-,22+/m0/s1