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CHEBI:157478 - CID 146017460

Default Structure
ChEBI IDCHEBI:157478
ChEBI NameCID 146017460
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC115H188N8O87
Net Charge0
Average Mass3074.738
Monoisotopic Mass3073.05327
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(=O)CO)[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](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@]7(C(=O)O)C[C@H](O)[C@@H](NC(=O)CO)[C@H]([C@H](O)[C@H](O)CO)O7)[C@H]6O)[C@H](O[C@@H]6O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]6O)[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(=O)CO)[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)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*NCCO/3=O][a1221m-1a_1-5]/1-1-2-3-1-4-5-1-6-4-5-3-1-4-5/a4-b1_b4-c1_c3-d1_c6-l1_d2-e1_d4-h1_e4-f1_f6-g2_h3-i1_h4-j1_j3-k2_l2-m1_m4-n1_n6-o2
InChIInChI=1S/C115H188N8O87/c1-27-61(152)74(165)78(169)103(185-27)203-93-60(120-32(6)142)102(192-46(20-134)89(93)202-107-83(174)95(68(159)40(14-128)187-107)210-115(112(180)181)9-35(145)55(123-52(151)23-137)92(209-115)64(155)38(148)12-126)198-88-45(19-133)193-109(97(81(88)172)206-101-59(119-31(5)141)73(164)86(43(17-131)191-101)200-105-80(171)76(167)67(158)49(196-105)26-184-114(111(178)179)8-34(144)54(122-51(150)22-136)91(208-114)63(154)37(147)11-125)204-94-69(160)47(194-106(82(94)173)201-87-44(18-132)189-99(57(71(87)162)117-29(3)139)197-84-41(15-129)186-98(175)56(70(84)161)116-28(2)138)24-182-108-96(77(168)65(156)39(13-127)188-108)205-100-58(118-30(4)140)72(163)85(42(16-130)190-100)199-104-79(170)75(166)66(157)48(195-104)25-183-113(110(176)177)7-33(143)53(121-50(149)21-135)90(207-113)62(153)36(146)10-124/h27,33-49,53-109,124-137,143-148,152-175H,7-26H2,1-6H3,(H,116,138)(H,117,139)(H,118,140)(H,119,141)(H,120,142)(H,121,149)(H,122,150)(H,123,151)(H,176,177)(H,178,179)(H,180,181)/t27-,33-,34-,35-,36+,37+,38+,39+,40+,41+,42+,43+,44+,45+,46+,47+,48+,49+,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-,109+,113+,114+,115-/m0/s1
InChIKeyHFVPXLKGZKPUGQ-HFOJBQDUSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 146017460 (CHEBI:157478) is a carbohydrates and carbohydrate derivatives (CHEBI:78616)
Synonyms  Source
3,5-dideoxy-5-glycolamido-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)-[3,5-dideoxy-5-glycolamido-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-alpha-D-manno-hexopyranosyl-(1->3)-[3,5-dideoxy-5-glycolamido-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)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranoseSUBMITTER
NeuGc(a2-6)Gal(b1-4)GlcNAc(b1-2)[NeuGc(a2-3)Gal(b1-4)[Fuc(a1-3)]GlcNAc(b1-4)]Man(a1-3)[NeuGc(a2-6)Gal(b1-4)GlcNAc(b1-2)Man(a1-6)]Man(b1-4)GlcNAc(b1-4)b-GlcNAcSUBMITTER
Manual XrefsDatabases
G09556KRGlyTouCan
G09556KRGlyGen