Structure

Cross-references

GlyTouCan : G31242TK

GlyGen : G31242TK

ChEBI : 149165

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Composition

Hex:9 HexNAc:2

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IUPAC

Galf(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)[Man(a1-2)Man(a1-2)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:a-dman-HEX-1:5
8b:a-dman-HEX-1:5
9b:a-dman-HEX-1:5
10b:a-dman-HEX-1:5
11b:a-dgal-HEX-1:4
12b:a-dman-HEX-1:5
13b: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
7:7o(2+1)8d
8:5o(6+1)9d
9:9o(3+1)10d
10:10o(2+1)11d
11:9o(6+1)12d
12:12o(2+1)13d

GWS

freeEnd--?b1D-GlcNAc,p--4b1D-GlcNAc,p--4b1Man(--3a1Man--2a1Man--2a1Man)--6a1Man(--3a1Man--2a1Gal,f)--6a1Man--2a1Man$MONO,Und,0,0,freeEnd

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[C@@H]6[C@H]([C@H]([C@@H]([C@H](O6)CO)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](O8)[C@@H](CO)O)O)O)O)O)O[C@@H]9[C@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)NC(=O)C)O

InCHI key

OXPOBDDLAQBVBO-SQVRSKANSA-N

InCHI

InChI=1S/C70H118N2O56/c1-14(82)71-27-37(93)52(23(10-80)110-60(27)107)121-61-28(72-15(2)83)38(94)53(24(11-81)117-61)122-66-50(106)55(124-69-59(44(100)34(90)21(8-78)115-69)128-70-58(43(99)33(89)22(9-79)116-70)126-64-47(103)40(96)30(86)18(5-75)112-64)36(92)26(119-66)12-108-62-49(105)54(123-68-57(42(98)32(88)20(7-77)114-68)127-65-48(104)45(101)51(120-65)16(84)3-73)35(91)25(118-62)13-109-67-56(41(97)31(87)19(6-76)113-67)125-63-46(102)39(95)29(85)17(4-74)111-63/h16-70,73-81,84-107H,3-13H2,1-2H3,(H,71,82)(H,72,83)/t16-,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+,55+,56+,57+,58+,59+,60-,61+,62+,63-,64-,65-,66+,67+,68-,69-,70-/m1/s1