CHEBI:148805 - CID 91850079

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name CID 91850079
ChEBI ID CHEBI:148805
Stars This entity has been manually annotated by a third party.
Submitter Gareth Owen
Supplier Information
Download Molfile XML SDF
Formula C120H200N6O90
Net Charge 0
Average Mass 3166.872
Monoisotopic Mass 3165.12577
InChI InChI=1S/C120H200N6O90/c1-25-55(147)72(164)78(170)109(185-25)183-24-48-95(66(158)49(103(181)186-48)121-26(2)141)204-106-52(124-29(5)144)69(161)93(42(18-137)197-106)209-118-88(180)100(214-120-102(216-108-54(126-31(7)146)71(163)92(44(20-139)199-108)208-117-87(179)99(64(156)39(15-134)194-117)213-113-82(174)76(168)59(151)35(11-130)190-113)83(175)94(45(21-140)200-120)203-105-51(123-28(4)143)68(160)90(41(17-136)196-105)206-115-85(177)97(62(154)37(13-132)192-115)211-111-80(172)74(166)57(149)33(9-128)188-111)65(157)47(201-118)23-184-119-101(215-107-53(125-30(6)145)70(162)91(43(19-138)198-107)207-116-86(178)98(63(155)38(14-133)193-116)212-112-81(173)75(167)58(150)34(10-129)189-112)77(169)60(152)46(202-119)22-182-104-50(122-27(3)142)67(159)89(40(16-135)195-104)205-114-84(176)96(61(153)36(12-131)191-114)210-110-79(171)73(165)56(148)32(8-127)187-110/h25,32-120,127-140,147-181H,8-24H2,1-7H3,(H,121,141)(H,122,142)(H,123,143)(H,124,144)(H,125,145)(H,126,146)/t25-,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+,111+,112+,113+,114-,115-,116-,117-,118-,119-,120+/m0/s1
InChIKey MWFAWALIYGMMRA-CKABWRJOSA-N
SMILES O([C@H]1O[C@@H]([C@@H](O[C@@H]2O[C@@H]([C@@H](O[C@@H]3O[C@@H]([C@H](O)[C@H](O[C@H]4O[C@@H]([C@H](O)[C@H](O)[C@H]4O)CO)[C@H]3O)CO)[C@H](O)[C@H]2NC(=O)C)CO)[C@H](O)[C@@H]1O[C@@H]5O[C@@H]([C@@H](O[C@@H]6O[C@@H]([C@H](O)[C@H](O[C@H]7O[C@@H]([C@H](O)[C@H](O)[C@H]7O)CO)[C@H]6O)CO)[C@H](O)[C@H]5NC(=O)C)CO)CO)[C@H]8[C@H](O)[C@H](O[C@@H](O[C@H]9[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]9CO)O[C@H]%10[C@H](O)[C@@H](NC(=O)C)C(O[C@@H]%10CO[C@@H]%11O[C@H]([C@@H](O)[C@@H](O)[C@@H]%11O)C)O)[C@H]8O)CO[C@H]%12O[C@@H]([C@@H](O)[C@H](O)[C@@H]%12O[C@@H]%13O[C@@H]([C@@H](O[C@@H]%14O[C@@H]([C@H](O)[C@H](O[C@H]%15O[C@@H]([C@H](O)[C@H](O)[C@H]%15O)CO)[C@H]%14O)CO)[C@H](O)[C@H]%13NC(=O)C)CO)CO[C@@H]%16O[C@@H]([C@@H](O[C@@H]%17O[C@@H]([C@H](O)[C@H](O[C@H]%18O[C@@H]([C@H](O)[C@H](O)[C@H]%18O)CO)[C@H]%17O)CO)[C@H](O)[C@H]%16NC(=O)C)CO
ChEBI Ontology
Outgoing CID 91850079 (CHEBI:148805) is a polysaccharide (CHEBI:18154)
Synonyms Sources
alpha-D-galacto-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[alpha-D-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)-[alpha-D-galacto-hexopyranosyl-(1->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[alpha-D-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->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-hexopyranose SUBMITTER
Gal(a1-3)Gal(b1-4)GlcNAc(b1-2)[Gal(a1-3)Gal(b1-4)GlcNAc(b1-4)]Man(a1-3)[Gal(a1-3)Gal(b1-4)GlcNAc(b1-2)[Gal(a1-3)Gal(b1-4)GlcNAc(b1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]GlcNAc SUBMITTER
WURCS=2.0/7,18,17/[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][a2112h-1a_1-5][a1221m-1a_1-5]/1-2-3-4-2-5-6-2-5-6-4-2-5-6-2-5-6-7/a4-b1_a6-r1_b4-c1_c3-d1_c6-k1_d2-e1_d4-h1_e4-f1_f3-g1_h4-i1_i3-j1_k2-l1_k6-o1_l4-m1_m3-n1_o4-p1_p3-q1 SUBMITTER
Manual Xrefs Databases
G29850BY GlyGen
G29850BY GlyTouCan
View more database links