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CHEBI:155102 - CID 91852295

ChEBI IDCHEBI:155102
ChEBI NameCID 91852295
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC102H170N6O74
Net Charge0
Average Mass2664.450
Monoisotopic Mass2662.97238
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]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]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@H](O)[C@H](O)[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](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]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H]2O)[C@@H]1O
WURCSWURCS=2.0/6,15,14/[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][a1221m-1a_1-5]/1-2-3-4-2-5-2-6-5-4-2-5-2-5-6/a4-b1_a6-o1_b4-c1_c3-d1_c6-j1_d2-e1_d6-g1_e4-f1_g3-h1_g4-i1_j2-k1_j6-m1_k4-l1_m4-n1
InChIInChI=1S/C102H170N6O74/c1-22-49(124)63(138)71(146)94(158-22)156-21-42-82(58(133)43(88(153)160-42)103-24(3)118)173-91-45(105-26(5)120)60(135)81(37(16-116)167-91)177-100-77(152)85(57(132)41(170-100)20-157-101-86(181-92-46(106-27(6)121)61(136)79(35(14-114)168-92)175-97-74(149)66(141)52(127)31(10-110)162-97)69(144)55(130)39(171-101)18-154-89-44(104-25(4)119)59(134)78(34(13-113)165-89)174-96-73(148)65(140)51(126)30(9-109)161-96)180-102-87(182-93-47(107-28(7)122)62(137)80(36(15-115)169-93)176-98-75(150)67(142)53(128)32(11-111)163-98)70(145)56(131)40(172-102)19-155-90-48(108-29(8)123)84(179-95-72(147)64(139)50(125)23(2)159-95)83(38(17-117)166-90)178-99-76(151)68(143)54(129)33(12-112)164-99/h22-23,30-102,109-117,124-153H,9-21H2,1-8H3,(H,103,118)(H,104,119)(H,105,120)(H,106,121)(H,107,122)(H,108,123)/t22-,23-,30+,31+,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+/m0/s1
InChIKeyFOUYEOAHTKENNF-KYKYAXTMSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 91852295 (CHEBI:155102) is a polysaccharide (CHEBI:18154)
Synonyms  Source
beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[6-deoxy-alpha-L-galacto-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->2)-[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
Gal(b1-4)GlcNAc(b1-2)[Fuc(a1-3)[Gal(b1-4)]GlcNAc(b1-6)]Man(a1-3)[Gal(b1-4)GlcNAc(b1-2)[Gal(b1-4)GlcNAc(b1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]GlcNAcSUBMITTER
Manual XrefsDatabases
G91452ZHGlyGen
G91452ZHGlyTouCan