Structure

Cross-references

GlyTouCan : G16828VN

GlyGen : G16828VN

ChEBI : 147471

UniCarb-DB :

• 2482
• 2499

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Composition

Hex:6 HexNAc:3

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IUPAC

Gal(b1-4)GlcNAc(b1-2)Man(a1-3)[Man(a1-3)[Man(a1-6)]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-dgal-HEX-1:5
10b:a-dman-HEX-1:5
11b:a-dman-HEX-1:5
12b: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
7:7d(2+1)8n
8:7o(4+1)9d
9:5o(6+1)10d
10:10o(3+1)11d
11:10o(6+1)12d

GWS

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

Glycam

DGalpb1-4DGlcpNAcb1-2DManpa1-3[DManpa1-3[DManpa1-6]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)O)O)O[C@@H]6[C@H]([C@H]([C@@H]([C@H](O6)CO)O)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]([C@H](O8)CO)O[C@H]9[C@@H]([C@H]([C@H]([C@H](O9)CO)O)O)O)O)NC(=O)C)O)O)NC(=O)C)O

InCHI key

PAIHNODGRPZDSN-MXXRXGFKSA-N

InCHI

InChI=1S/C60H101N3O46/c1-13(71)61-25-34(80)46(20(8-68)95-52(25)92)104-53-26(62-14(2)72)35(81)48(22(10-70)100-53)106-59-45(91)50(108-60-51(40(86)31(77)19(7-67)99-60)109-54-27(63-15(3)73)36(82)47(21(9-69)101-54)105-57-42(88)38(84)29(75)17(5-65)97-57)33(79)24(103-59)12-94-56-44(90)49(107-58-43(89)39(85)30(76)18(6-66)98-58)32(78)23(102-56)11-93-55-41(87)37(83)28(74)16(4-64)96-55/h16-60,64-70,74-92H,4-12H2,1-3H3,(H,61,71)(H,62,72)(H,63,73)/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-/m1/s1