Complex glycan structure

Cross-references

GlyTouCan : G20030CU

GlyGen : G20030CU

ChEBI : 148240

UniCarb-DB :

• 550
• 574
• 598

---

Composition

Hex:3 HexNAc:6

---

IUPAC

GlcNAc(b1-2)[GlcNAc(b1-4)]Man(a1-3)[GlcNAc(b1-2)[GlcNAc(b1-6)]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:b-dglc-HEX-1:5
8s:n-acetyl
9b:b-dglc-HEX-1:5
10s:n-acetyl
11b:a-dman-HEX-1:5
12b:b-dglc-HEX-1:5
13s:n-acetyl
14b:b-dglc-HEX-1:5
15s:n-acetyl
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
8:6o(4+1)9d
9:9d(2+1)10n
10:5o(6+1)11d
11:11o(2+1)12d
12:12d(2+1)13n
13:11o(6+1)14d
14:14d(2+1)15n

GWS

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

Glycam

DGlcpNAcb1-2[DGlcpNAcb1-4]DManpa1-3[DGlcpNAcb1-2[DGlcpNAcb1-6]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)NC(=O)C)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)NC(=O)C)O)O[C@@H]7[C@H]([C@H]([C@@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)NC(=O)C)O)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)NC(=O)C)O)O)NC(=O)C)O

InCHI key

GIXKAAIKLHPCDX-RATNYEBGSA-N

InCHI

InChI=1S/C66H110N6O46/c1-16(80)67-31-47(96)52(26(11-77)104-58(31)101)113-63-36(72-21(6)85)48(97)53(27(12-78)109-63)115-64-51(100)55(116-66-57(118-62-35(71-20(5)84)46(95)40(89)25(10-76)108-62)50(99)54(28(13-79)110-66)114-60-33(69-18(3)82)44(93)38(87)23(8-74)106-60)42(91)30(111-64)15-103-65-56(117-61-34(70-19(4)83)45(94)39(88)24(9-75)107-61)49(98)41(90)29(112-65)14-102-59-32(68-17(2)81)43(92)37(86)22(7-73)105-59/h22-66,73-79,86-101H,7-15H2,1-6H3,(H,67,80)(H,68,81)(H,69,82)(H,70,83)(H,71,84)(H,72,85)/t22-,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+,65+,66-/m1/s1