Core 2 glycan structure
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3D structure from GLYCAM
Cross-references
GlyTouCan : G25764DO
GlyGen : G25764DO
ChEBI : 148516
Composition
IUPAC
Fuc(a1-2)[Gal(a1-4)]Gal(b1-3)[GlcNAc(b1-6)]GalNAc
GlycoCT
RES 1b:a-dgal-HEX-1:5 2s:n-acetyl 3b:b-dgal-HEX-1:5 4b:a-lgal-HEX-1:5|6:d 5b:a-dgal-HEX-1:5 6b:b-dglc-HEX-1:5 7s:n-acetyl LIN 1:1d(2+1)2n 2:1o(3+1)3d 3:3o(2+1)4d 4:3o(4+1)5d 5:1o(6+1)6d 6:6d(2+1)7n
GWS
freeEnd--?a1D-GalNAc,p(--3b1D-Gal,p(--2a1L-Fuc,p)--4a1D-Gal,p)--6b1D-GlcNAc,p$MONO,Und,0,0,freeEnd
Glycam
DGalpa1-4[LFucpa1-2]DGalpb1-3[DGlcpNAcb1-6]DGalpNAca1-OH
SMILES
C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2[C@H]([C@H]([C@H](O[C@H]2O[C@@H]3[C@H]([C@H](O[C@@H]([C@@H]3O)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)NC(=O)C)O)NC(=O)C)CO)O[C@@H]5[C@@H]([C@H]([C@H]([C@H](O5)CO)O)O)O)O)O)O)O
InCHI key
IVVWACMUAVNTDN-PTJQJFKOSA-N
InCHI
InChI=1S/C34H58N2O25/c1-8-17(42)22(47)24(49)32(54-8)61-29-26(51)27(59-33-25(50)23(48)19(44)12(5-38)57-33)13(6-39)58-34(29)60-28-16(36-10(3)41)30(52)55-14(20(28)45)7-53-31-15(35-9(2)40)21(46)18(43)11(4-37)56-31/h8,11-34,37-39,42-52H,4-7H2,1-3H3,(H,35,40)(H,36,41)/t8-,11+,12+,13+,14+,15+,16+,17+,18+,19-,20-,21+,22+,23-,24-,25+,26-,27-,28+,29+,30-,31+,32-,33+,34-/m0/s1