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CHEBI:148811 - CID 71297974

ChEBI IDCHEBI:148811
ChEBI NameCID 71297974
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC146H238N10O106
Net Charge0
Average Mass3829.474
Monoisotopic Mass3827.35405
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](NC(C)=O)C(O)O[C@@H]2CO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO[C@H]3O[C@H](CO[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]3O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@]5(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O5)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H](O)[C@H](O[C@H]3O[C@H](CO)[C@@H](O[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]5O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]5O)[C@H]4NC(C)=O)[C@H](O)[C@@H]3O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@]5(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O5)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H]2O)[C@@H]1O
WURCSWURCS=2.0/7,19,18/[a2122h-1x_1-5_2*NCC/3=O][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]/1-2-3-4-2-5-6-2-7-5-6-4-2-5-6-2-5-6-7/a4-b1_a6-s1_b4-c1_c3-d1_c6-l1_d2-e1_d4-h1_e4-f1_f3-g2_h3-i1_h4-j1_j3-k2_l2-m1_l6-p1_m4-n1_n3-o2_p4-q1_q3-r2
InChIInChI=1S/C146H238N10O106/c1-34-77(189)94(206)97(209)130(229-34)227-33-66-110(89(201)71(124(217)231-66)151-40(7)175)245-126-73(153-42(9)177)91(203)106(59(26-166)237-126)246-132-100(212)117(88(200)65(242-132)32-228-137-122(253-127-74(154-43(10)178)92(204)107(60(27-167)238-127)248-134-102(214)119(85(197)55(22-162)233-134)260-144(140(220)221)14-47(182)68(148-37(4)172)113(256-144)80(192)51(186)18-158)96(208)83(195)64(243-137)31-226-125-72(152-41(8)176)90(202)105(58(25-165)236-125)247-133-101(213)118(84(196)54(21-161)232-133)259-143(139(218)219)13-46(181)67(147-36(3)171)112(255-143)79(191)50(185)17-157)252-138-123(254-128-75(155-44(11)179)93(205)108(61(28-168)239-128)249-135-103(215)120(86(198)56(23-163)234-135)261-145(141(222)223)15-48(183)69(149-38(5)173)114(257-145)81(193)52(187)19-159)99(211)109(62(29-169)241-138)244-129-76(156-45(12)180)116(251-131-98(210)95(207)78(190)35(2)230-131)111(63(30-170)240-129)250-136-104(216)121(87(199)57(24-164)235-136)262-146(142(224)225)16-49(184)70(150-39(6)174)115(258-146)82(194)53(188)20-160/h34-35,46-138,157-170,181-217H,13-33H2,1-12H3,(H,147,171)(H,148,172)(H,149,173)(H,150,174)(H,151,175)(H,152,176)(H,153,177)(H,154,178)(H,155,179)(H,156,180)(H,218,219)(H,220,221)(H,222,223)(H,224,225)/t34-,35-,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+,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+,143-,144-,145-,146-/m0/s1
InChIKeyXYCNKNLJPCUMMS-OXDDEHLESA-N
ChEBI Ontology
Outgoing Relation(s)
CID 71297974 (CHEBI:148811) is a polysaccharide (CHEBI:18154)
Synonyms  Source
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)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)]-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->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->6)]-alpha-D-manno-hexopyranosyl-(1->6)]-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-D-gluco-hexopyranoseSUBMITTER
NeuAc(a2-3)Gal(b1-4)GlcNAc(b1-2)[NeuAc(a2-3)Gal(b1-4)[Fuc(a1-3)]GlcNAc(b1-4)]Man(a1-3)[NeuAc(a2-3)Gal(b1-4)GlcNAc(b1-2)[NeuAc(a2-3)Gal(b1-4)GlcNAc(b1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]GlcNAcSUBMITTER
Manual XrefsDatabases
G24125FEGlyTouCan
G24125FEGlyGen