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CHEBI:148207 - CID 91848437

ChEBI IDCHEBI:148207
ChEBI NameCID 91848437
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)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@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@]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](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@]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=2.0/7,19,18/[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]/1-2-3-4-2-5-6-2-7-5-6-4-2-5-6-2-7-5-6/a4-b1_b4-c1_c3-d1_c6-l1_d2-e1_d4-h1_e4-f1_f6-g2_h3-i1_h4-j1_j3-k2_l2-m1_l4-p1_m4-n1_n6-o2_p3-q1_p4-r1_r3-s2
InChIInChI=1S/C146H238N10O106/c1-34-77(189)92(204)96(208)130(229-34)252-117-75(155-44(11)179)128(237-62(29-169)111(117)250-135-103(215)120(85(197)54(21-161)232-135)261-145(141(222)223)15-48(183)69(149-38(5)173)115(259-145)81(193)52(187)19-159)245-109-60(27-167)239-137(122(100(109)212)255-126-73(153-42(9)177)90(202)106(57(24-164)235-126)247-132-98(210)94(206)83(195)65(242-132)32-227-143(139(218)219)13-46(181)67(147-36(3)171)113(257-143)79(191)50(185)17-157)226-31-64-87(199)119(102(214)134(241-64)249-108-59(26-166)234-125(72(89(108)201)152-41(8)176)244-105-56(23-163)231-124(217)71(88(105)200)151-40(7)175)254-138-123(256-127-74(154-43(10)178)91(203)107(58(25-165)236-127)248-133-99(211)95(207)84(196)66(243-133)33-228-144(140(220)221)14-47(182)68(148-37(4)172)114(258-144)80(192)51(186)18-158)101(213)110(61(28-168)240-138)246-129-76(156-45(12)180)118(253-131-97(209)93(205)78(190)35(2)230-131)112(63(30-170)238-129)251-136-104(216)121(86(198)55(22-162)233-136)262-146(142(224)225)16-49(184)70(150-39(6)174)116(260-146)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
InChIKeyQMENBJRCSLREIK-AOMWVVTJSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 91848437 (CHEBI:148207) 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->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->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->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->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-D-gluco-hexopyranoseSUBMITTER
NeuAc(a2-6)Gal(b1-4)GlcNAc(b1-2)[NeuAc(a2-3)Gal(b1-4)[Fuc(a1-3)]GlcNAc(b1-4)]Man(a1-3)[NeuAc(a2-6)Gal(b1-4)GlcNAc(b1-2)[NeuAc(a2-3)Gal(b1-4)[Fuc(a1-3)]GlcNAc(b1-4)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAcSUBMITTER
Manual XrefsDatabases
G19636RYGlyTouCan
G19636RYGlyGen