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CHEBI:150034 - CID 91855732

Default Structure
ChEBI IDCHEBI:150034
ChEBI NameCID 91855732
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC126H209N9O90
Net Charge0
Average Mass3290.031
Monoisotopic Mass3288.20541
SMILESCC(=O)N[C@H]1[C@H](O[C@@H]2[C@@H](OC[C@H]3O[C@@H](O[C@H]4[C@H](O)[C@@H](NC(C)=O)[C@H](O[C@H]5[C@H](O)[C@@H](NC(C)=O)C(O)O[C@@H]5CO[C@@H]5O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]5O)O[C@@H]4CO)[C@@H](O)[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]5NC(C)=O)[C@H](O)[C@@H]4O[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@H]7O)[C@H](O)[C@H]6NC(C)=O)[C@H]5O)[C@H](O)[C@H]4NC(C)=O)[C@@H]3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(C)=O)O[C@H](CO[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]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[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](O)[C@H]4O)[C@H](O)[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][a2112h-1b_1-5][a1221m-1a_1-5]/1-2-3-4-2-5-2-5-2-2-4-2-5-2-5-2-5-6/a4-b1_a6-r1_b4-c1_c3-d1_c4-j1_c6-k1_d2-e1_d4-i1_e4-f1_f3-g1_g4-h1_k2-l1_k6-p1_l4-m1_m3-n1_n4-o1_p4-q1
InChIInChI=1S/C126H209N9O90/c1-28-64(159)82(177)87(182)118(194-28)192-26-53-102(75(170)55(109(190)195-53)127-29(2)150)213-113-59(131-33(6)154)77(172)100(48(21-146)204-113)219-124-94(189)106(223-126-108(91(186)101(51(24-149)209-126)212-111-56(128-30(3)151)73(168)65(160)38(11-136)196-111)225-117-63(135-37(10)158)81(176)99(50(23-148)208-117)218-123-93(188)105(72(167)44(17-142)202-123)222-115-61(133-35(8)156)79(174)97(47(20-145)206-115)216-121-90(185)85(180)69(164)42(15-140)200-121)103(220-112-57(129-31(4)152)74(169)66(161)39(12-137)197-112)54(211-124)27-193-125-107(86(181)70(165)52(210-125)25-191-110-58(130-32(5)153)76(171)95(45(18-143)203-110)214-119-88(183)83(178)67(162)40(13-138)198-119)224-116-62(134-36(9)157)80(175)98(49(22-147)207-116)217-122-92(187)104(71(166)43(16-141)201-122)221-114-60(132-34(7)155)78(173)96(46(19-144)205-114)215-120-89(184)84(179)68(163)41(14-139)199-120/h28,38-126,136-149,159-190H,11-27H2,1-10H3,(H,127,150)(H,128,151)(H,129,152)(H,130,153)(H,131,154)(H,132,155)(H,133,156)(H,134,157)(H,135,158)/t28-,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-,125-,126+/m0/s1
InChIKeyIAHGXIFZQJHZJV-VXFBJPIZSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 91855732 (CHEBI:150034) is a carbohydrates and carbohydrate derivatives (CHEBI:78616)
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)-[2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-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)-[beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->6)]-alpha-D-manno-hexopyranosyl-(1->6)][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)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->6)]-2-acetamido-2-deoxy-D-gluco-hexopyranoseSUBMITTER
Gal(b1-4)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-2)[GlcNAc(b1-4)]Man(a1-3)[Gal(b1-4)GlcNAc(b1-3)Gal(b1-4)GlcNAc(b1-2)[Gal(b1-4)GlcNAc(b1-6)]Man(a1-6)][GlcNAc(b1-4)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]GlcNAcSUBMITTER
Manual XrefsDatabases
G40069AVGlyGen
G40069AVGlyTouCan