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CHEBI:156644 - CID 146017885

Default Structure
ChEBI IDCHEBI:156644
ChEBI NameCID 146017885
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC112H184N8O81
Net Charge0
Average Mass2938.679
Monoisotopic Mass2937.05248
SMILESCC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO[C@]6(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O6)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4NC(C)=O)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4NC(C)=O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5NC(C)=O)[C@H](O)[C@@H]4O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO[C@]6(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O6)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4NC(C)=O)[C@@H]3O)[C@H](O)[C@H]2NC(C)=O)[C@@H](CO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)O[C@H]1O
WURCSWURCS=2.0/6,15,14/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2112h-1b_1-5][Aad21122h-2a_2-6_5*NCC/3=O][a1221m-1a_1-5]/1-1-2-3-1-4-5-1-4-1-3-1-4-5-6/a4-b1_a6-o1_b4-c1_c3-d1_c4-j1_c6-k1_d2-e1_d4-h1_e4-f1_f6-g2_h4-i1_k2-l1_l4-m1_m6-n2
InChIInChI=1S/C112H184N8O81/c1-26-59(143)73(157)78(162)102(177-26)173-22-49-89(68(152)53(96(168)178-49)115-29(4)133)191-99-56(118-32(7)136)70(154)87(45(20-129)183-99)195-106-83(167)93(90(196-97-54(116-30(5)134)67(151)62(146)39(14-123)179-97)50(189-106)23-174-107-94(77(161)64(148)41(16-125)181-107)198-100-57(119-33(8)137)71(155)85(43(18-127)184-100)193-104-80(164)75(159)65(149)47(187-104)24-175-111(109(169)170)10-35(139)51(113-27(2)131)91(200-111)60(144)37(141)12-121)197-108-95(82(166)88(46(21-130)186-108)190-98-55(117-31(6)135)69(153)84(42(17-126)182-98)192-103-79(163)74(158)63(147)40(15-124)180-103)199-101-58(120-34(9)138)72(156)86(44(19-128)185-101)194-105-81(165)76(160)66(150)48(188-105)25-176-112(110(171)172)11-36(140)52(114-28(3)132)92(201-112)61(145)38(142)13-122/h26,35-108,121-130,139-168H,10-25H2,1-9H3,(H,113,131)(H,114,132)(H,115,133)(H,116,134)(H,117,135)(H,118,136)(H,119,137)(H,120,138)(H,169,170)(H,171,172)/t26-,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+,71+,72+,73+,74-,75-,76-,77-,78-,79+,80+,81+,82-,83-,84+,85+,86+,87+,88+,89+,90+,91+,92+,93+,94-,95-,96+,97-,98-,99-,100-,101-,102+,103-,104-,105-,106-,107-,108+,111+,112+/m0/s1
InChIKeyGCYUPDULTAXYPJ-WUNLBMFFSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 146017885 (CHEBI:156644) is a carbohydrates and carbohydrate derivatives (CHEBI:78616)
Synonyms  Source
5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->6)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-alpha-D-manno-hexopyranosyl-(1->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->6)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->6)][2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->6)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranoseSUBMITTER
NeuAc(a2-6)Gal(b1-4)GlcNAc(b1-2)[Gal(b1-4)GlcNAc(b1-4)]Man(a1-3)[NeuAc(a2-6)Gal(b1-4)GlcNAc(b1-2)Man(a1-6)][GlcNAc(b1-4)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]b-GlcNAcSUBMITTER
Manual XrefsDatabases
G32808NLGlyGen
G32808NLGlyTouCan