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CHEBI:149092 - CID 91858279

ChEBI IDCHEBI:149092
ChEBI NameCID 91858279
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC110H183N7O81
Net Charge0
Average Mass2899.642
Monoisotopic Mass2898.04158
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]3[C@H](O)[C@@H](NC(C)=O)[C@H](OC[C@H]4O[C@H](O[C@@H]5[C@H](O)[C@H](O[C@H]6[C@H](O)[C@@H](NC(C)=O)C(O)O[C@@H]6CO)O[C@H](CO[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O[C@@H]8O[C@H](CO)[C@@H](O[C@@H]9O[C@H](CO)[C@H](O)[C@H](O)[C@H]9O)[C@H](O)[C@H]8NC(C)=O)[C@H]7O)[C@H](O)[C@H]6NC(C)=O)[C@H]5O)[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@@H]7O[C@H](CO)[C@@H](O[C@@H]8O[C@H](CO)[C@H](O)[C@H](O)[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]4O)O[C@@H]3CO)[C@@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O
WURCSWURCS=2.0/5,16,15/[a2122h-1x_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5]/1-2-3-4-5-4-5-4-5-4-5-3-4-5-4-5/a4-b1_b3-c1_b6-l1_c2-d1_c6-h1_d4-e1_e3-f1_f4-g1_h4-i1_i3-j1_j4-k1_l2-m1_m4-n1_n3-o1_o4-p1
InChIInChI=1S/C110H183N7O81/c1-24(132)111-47-63(148)82(38(15-125)170-95(47)167)189-108-81(166)92(62(147)46(184-108)23-169-109-93(73(158)57(142)34(11-121)177-109)197-100-52(116-29(6)137)68(153)87(43(20-130)182-100)191-106-79(164)90(60(145)36(13-123)175-106)194-98-50(114-27(4)135)66(151)85(41(18-128)180-98)187-103-76(161)71(156)55(140)32(9-119)172-103)196-110-94(198-101-53(117-30(7)138)69(154)88(44(21-131)183-101)192-107-80(165)91(61(146)37(14-124)176-107)195-99-51(115-28(5)136)67(152)86(42(19-129)181-99)188-104-77(162)72(157)56(141)33(10-120)173-104)74(159)58(143)45(185-110)22-168-96-48(112-25(2)133)64(149)83(39(16-126)178-96)190-105-78(163)89(59(144)35(12-122)174-105)193-97-49(113-26(3)134)65(150)84(40(17-127)179-97)186-102-75(160)70(155)54(139)31(8-118)171-102/h31-110,118-131,139-167H,8-23H2,1-7H3,(H,111,132)(H,112,133)(H,113,134)(H,114,135)(H,115,136)(H,116,137)(H,117,138)/t31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,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-/m1/s1
InChIKeyFPGJHUMWPJDBIA-LIDCBCQXSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 91858279 (CHEBI:149092) is a polysaccharide (CHEBI:18154)
Synonyms  Source
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)-[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->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)-alpha-D-manno-hexopyranosyl-(1->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-D-gluco-hexopyranoseSUBMITTER
Gal(b1-4)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-2)[Gal(b1-4)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-6)]Man(a1-3)[Gal(b1-4)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-2)Man(a1-6)]Man(b1-4)GlcNAcSUBMITTER
Manual XrefsDatabases
G25155KVGlyTouCan
G25155KVGlyGen