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CHEBI:156638 - CID 146017870

Default Structure
ChEBI IDCHEBI:156638
ChEBI NameCID 146017870
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC154H251N11O113
Net Charge0
Average Mass4064.666
Monoisotopic Mass4062.42325
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]5O[C@H](CO)[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O[C@@H]8O[C@H](CO)[C@H](O)[C@H](O[C@]9(C(=O)O)C[C@H](O)[C@@H](NC(=O)CO)[C@H]([C@H](O)[C@H](O)CO)O9)[C@H]8O)[C@H](O)[C@H]7NC(C)=O)[C@H]6O)[C@H](O)[C@H]5NC(C)=O)[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@H](O)[C@H](O[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]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(C)=O)[C@H]([C@H](O)[C@H](O)CO)O7)[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@H](O)[C@H](O[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]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=2.0/7,20,19/[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][Aad21122h-2a_2-6_5*NCCO/3=O][a1221m-1a_1-5]/1-1-2-3-1-4-5-1-4-5-3-1-4-5-1-4-1-4-6-7/a4-b1_a6-t1_b4-c1_c3-d1_c6-k1_d2-e1_d4-h1_e4-f1_f3-g2_h4-i1_i3-j2_k2-l1_k6-o1_l4-m1_m3-n2_o4-p1_p3-q1_q4-r1_r3-s2
InChIInChI=1S/C154H251N11O113/c1-36-82(202)101(221)103(223)138(243-36)241-35-69-118(94(214)75(131(231)244-69)158-40(5)186)260-134-78(161-43(8)189)97(217)112(61(26-176)252-134)262-140-106(226)124(268-146-130(270-137-81(164-46(11)192)100(220)116(65(30-180)255-137)266-144-109(229)127(91(211)58(23-173)249-144)277-153(149(236)237)14-49(195)73(157-39(4)185)121(273-153)85(205)53(199)18-168)104(224)117(66(31-181)256-146)259-133-77(160-42(7)188)96(216)113(62(27-177)251-133)263-141-107(227)125(89(209)56(21-171)246-141)275-151(147(232)233)12-47(193)71(155-37(2)183)119(271-151)83(203)51(197)16-166)93(213)68(257-140)34-242-145-129(269-136-80(163-45(10)191)99(219)115(64(29-179)254-136)265-143-108(228)126(90(210)57(22-172)248-143)276-152(148(234)235)13-48(194)72(156-38(3)184)120(272-152)84(204)52(198)17-167)102(222)87(207)67(258-145)33-240-132-76(159-41(6)187)95(215)111(60(25-175)250-132)261-139-105(225)123(88(208)55(20-170)245-139)267-135-79(162-44(9)190)98(218)114(63(28-178)253-135)264-142-110(230)128(92(212)59(24-174)247-142)278-154(150(238)239)15-50(196)74(165-70(201)32-182)122(274-154)86(206)54(200)19-169/h36,47-69,71-146,166-182,193-200,202-231H,12-35H2,1-11H3,(H,155,183)(H,156,184)(H,157,185)(H,158,186)(H,159,187)(H,160,188)(H,161,189)(H,162,190)(H,163,191)(H,164,192)(H,165,201)(H,232,233)(H,234,235)(H,236,237)(H,238,239)/t36-,47-,48-,49-,50-,51+,52+,53+,54+,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,66+,67+,68+,69+,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+,110+,111+,112+,113+,114+,115+,116+,117+,118+,119+,120+,121+,122+,123-,124-,125-,126-,127-,128-,129-,130-,131+,132+,133-,134-,135-,136-,137-,138+,139-,140-,141-,142-,143-,144-,145-,146+,151-,152-,153-,154-/m0/s1
InChIKeyBIGWIYZJCGWFMA-UCJGNCCUSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 146017870 (CHEBI:156638) 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->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->6)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)]-alpha-D-manno-hexopyranosyl-(1->6)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-alpha-D-manno-hexopyranosyl-(1->3)]-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
NeuGc(a2-3)Gal(b1-4)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-6)[NeuAc(a2-3)Gal(b1-4)GlcNAc(b1-2)]Man(a1-6)[NeuAc(a2-3)Gal(b1-4)GlcNAc(b1-2)[NeuAc(a2-3)Gal(b1-4)GlcNAc(b1-4)]Man(a1-3)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]b-GlcNAcSUBMITTER
Manual XrefsDatabases
G41711ZZGlyGen
G41711ZZGlyTouCan