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CHEBI:148106 - CID 71298012

ChEBI IDCHEBI:148106
ChEBI NameCID 71298012
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC143H234N10O104
Net Charge0
Average Mass3757.411
Monoisotopic Mass3755.33292
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@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O[C@]8(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O8)[C@H]7O)[C@H](O)[C@H]6NC(C)=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@H](O)[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]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](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]/1-2-3-4-2-5-6-4-2-5-2-5-6-2-5-2-5-6-7/a4-b1_a6-s1_b4-c1_c3-d1_c6-h1_d2-e1_e4-f1_f3-g2_h2-i1_h6-n1_i4-j1_j3-k1_k4-l1_l3-m2_n4-o1_o3-p1_p4-q1_q3-r2
InChIInChI=1S/C143H234N10O104/c1-33-75(185)94(204)97(207)129(224-33)222-32-64-110(87(197)68(122(214)225-64)147-37(5)172)240-124-70(149-39(7)174)89(199)106(57(25-164)233-124)243-132-100(210)116(249-137-121(95(205)79(189)50(18-157)231-137)251-128-74(153-43(11)178)93(203)109(61(29-168)237-128)246-135-103(213)119(85(195)55(23-162)230-135)257-143(140(219)220)14-46(181)67(146-36(4)171)113(254-143)78(188)49(184)17-156)86(196)63(238-132)31-223-136-120(250-127-73(152-42(10)177)92(202)105(60(28-167)236-127)242-131-99(209)115(82(192)52(20-159)227-131)248-126-72(151-41(9)176)91(201)108(59(27-166)235-126)245-134-102(212)118(84(194)54(22-161)229-134)256-142(139(217)218)13-45(180)66(145-35(3)170)112(253-142)77(187)48(183)16-155)96(206)80(190)62(239-136)30-221-123-69(148-38(6)173)88(198)104(56(24-163)232-123)241-130-98(208)114(81(191)51(19-158)226-130)247-125-71(150-40(8)175)90(200)107(58(26-165)234-125)244-133-101(211)117(83(193)53(21-160)228-133)255-141(138(215)216)12-44(179)65(144-34(2)169)111(252-141)76(186)47(182)15-154/h33,44-137,154-168,179-214H,12-32H2,1-11H3,(H,144,169)(H,145,170)(H,146,171)(H,147,172)(H,148,173)(H,149,174)(H,150,175)(H,151,176)(H,152,177)(H,153,178)(H,215,216)(H,217,218)(H,219,220)/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-,133-,134-,135-,136-,137+,141-,142-,143-/m0/s1
InChIKeyHZQRPRNSFRNIKT-JHNCYPTISA-N
ChEBI Ontology
Outgoing Relation(s)
CID 71298012 (CHEBI:148106) 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->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->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->6)]-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)-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-D-gluco-hexopyranoseSUBMITTER
NeuAc(a2-3)Gal(b1-4)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-2)[NeuAc(a2-3)Gal(b1-4)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-6)]Man(a1-6)[NeuAc(a2-3)Gal(b1-4)GlcNAc(b1-2)Man(a1-3)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]GlcNAcSUBMITTER
Manual XrefsDatabases
G16403CCGlyGen
G16403CCGlyTouCan