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CHEBI:147240 - CID 91859273

ChEBI IDCHEBI:147240
ChEBI NameCID 91859273
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC124H206N8O89
Net Charge0
Average Mass3232.979
Monoisotopic Mass3231.18395
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]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]5O[C@H](CO)[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[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]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(C)=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@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@H](O)[C@H](O)[C@H]4O)[C@H](O[C@@H]4O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]4O)[C@H]3NC(C)=O)[C@@H]2O)[C@@H]1O
WURCSWURCS=2.0/6,18,17/[a2122h-1x_1-5_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a1221m-1a_1-5][a2112h-1b_1-5]/1-2-3-4-2-5-6-2-5-6-2-4-2-6-2-6-2-6/a4-b1_b4-c1_c3-d1_c4-k1_c6-l1_d2-e1_d4-h1_e3-f1_e4-g1_h3-i1_h4-j1_l2-m1_l6-q1_m4-n1_n3-o1_o4-p1_q4-r1
InChIInChI=1S/C124H206N8O89/c1-27-61(155)76(170)83(177)115(189-27)216-101-59(131-35(9)153)113(202-49(23-145)98(101)214-119-87(181)80(174)66(160)40(14-136)195-119)208-97-48(22-144)204-124(106(89(97)183)221-114-60(132-36(10)154)102(217-116-84(178)77(171)62(156)28(2)190-116)99(50(24-146)203-114)215-120-88(182)81(175)67(161)41(15-137)196-120)219-104-91(185)122(212-96-46(20-142)199-110(56(73(96)167)128-32(6)150)207-92-43(17-139)191-107(186)53(71(92)165)125-29(3)147)206-52(100(104)213-109-54(126-30(4)148)70(164)63(157)37(11-133)192-109)26-188-123-105(82(176)68(162)51(205-123)25-187-108-55(127-31(5)149)72(166)93(44(18-140)198-108)209-117-85(179)78(172)64(158)38(12-134)193-117)220-112-58(130-34(8)152)75(169)95(47(21-143)201-112)211-121-90(184)103(69(163)42(16-138)197-121)218-111-57(129-33(7)151)74(168)94(45(19-141)200-111)210-118-86(180)79(173)65(159)39(13-135)194-118/h27-28,37-124,133-146,155-186H,11-26H2,1-10H3,(H,125,147)(H,126,148)(H,127,149)(H,128,150)(H,129,151)(H,130,152)(H,131,153)(H,132,154)/t27-,28-,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-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124+/m0/s1
InChIKeySDMZVQONLWVBPC-WQYULJSKSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 91859273 (CHEBI:147240) 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->6)]-alpha-D-manno-hexopyranosyl-(1->6)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)-[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->4)]-alpha-D-manno-hexopyranosyl-(1->3)][2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-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(b1-6)]Man(a1-6)[Fuc(a1-3)[Gal(b1-4)]GlcNAc(b1-2)[Fuc(a1-3)[Gal(b1-4)]GlcNAc(b1-4)]Man(a1-3)][GlcNAc(b1-4)]Man(b1-4)GlcNAc(b1-4)GlcNAcSUBMITTER
Manual XrefsDatabases
G07865ETGlyGen
G07865ETGlyTouCan