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CHEBI:149269 - CID 91859934

ChEBI IDCHEBI:149269
ChEBI NameCID 91859934
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC140H228N10O102
Net Charge0
Average Mass3683.332
Monoisotopic Mass3681.29614
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](O[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]3O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO[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](O)[C@H](O)[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]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](O)[C@@H]3O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO[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](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H]2O)[C@@H]1O
WURCSWURCS=2.0/7,18,17/[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]/1-2-3-4-2-5-6-2-5-6-4-2-5-6-2-5-6-7/a4-b1_a6-r1_b4-c1_c3-d1_c6-k1_d2-e1_d6-h1_e4-f1_f6-g2_h4-i1_i6-j2_k2-l1_k4-o1_l4-m1_m6-n2_o4-p1_p6-q2
InChIInChI=1S/C140H228N10O102/c1-33-75(179)92(196)98(202)125(225-33)219-28-64-111(86(190)69(119(209)226-64)145-38(6)165)240-122-72(148-41(9)168)89(193)109(56(24-159)229-122)245-130-104(208)116(246-132-117(247-123-73(149-42(10)169)90(194)107(54(22-157)230-123)243-128-101(205)95(199)82(186)62(236-128)31-223-139(135(214)215)14-46(173)67(143-36(4)163)114(251-139)78(182)50(177)18-153)97(201)84(188)58(238-132)26-218-120-70(146-39(7)166)87(191)105(52(20-155)227-120)241-126-99(203)93(197)80(184)60(234-126)29-221-137(133(210)211)12-44(171)65(141-34(2)161)112(249-137)76(180)48(175)16-151)85(189)59(233-130)27-220-131-118(248-124-74(150-43(11)170)91(195)108(55(23-158)231-124)244-129-102(206)96(200)83(187)63(237-129)32-224-140(136(216)217)15-47(174)68(144-37(5)164)115(252-140)79(183)51(178)19-154)103(207)110(57(25-160)232-131)239-121-71(147-40(8)167)88(192)106(53(21-156)228-121)242-127-100(204)94(198)81(185)61(235-127)30-222-138(134(212)213)13-45(172)66(142-35(3)162)113(250-138)77(181)49(176)17-152/h33,44-132,151-160,171-209H,12-32H2,1-11H3,(H,141,161)(H,142,162)(H,143,163)(H,144,164)(H,145,165)(H,146,166)(H,147,167)(H,148,168)(H,149,169)(H,150,170)(H,210,211)(H,212,213)(H,214,215)(H,216,217)/t33-,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+,109+,110+,111+,112+,113+,114+,115+,116-,117-,118-,119?,120+,121-,122-,123-,124-,125+,126-,127-,128-,129-,130-,131-,132+,137+,138+,139+,140+/m0/s1
InChIKeyKFDCTEGGBLGHOJ-UEOXYRCNSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 91859934 (CHEBI:149269) is a polysaccharide (CHEBI:18154)
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)-[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->6)]-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)-[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->4)]-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(a2-6)Gal(b1-4)GlcNAc(b1-2)[NeuAc(a2-6)Gal(b1-4)GlcNAc(b1-6)]Man(a1-3)[NeuAc(a2-6)Gal(b1-4)GlcNAc(b1-2)[NeuAc(a2-6)Gal(b1-4)GlcNAc(b1-4)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]GlcNAcSUBMITTER
Manual XrefsDatabases
G32483HZGlyGen
G32483HZGlyTouCan