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CHEBI:147959 - CID 91849765

ChEBI IDCHEBI:147959
ChEBI NameCID 91849765
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC116H193N7O84
Net Charge0
Average Mass3029.785
Monoisotopic Mass3028.10458
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](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=2.0/6,17,16/[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]/1-2-3-4-2-5-6-2-5-6-4-2-6-2-6-2-6/a4-b1_b4-c1_c3-d1_c6-k1_d2-e1_d4-h1_e3-f1_e4-g1_h3-i1_h4-j1_k2-l1_k6-p1_l4-m1_m3-n1_n4-o1_p4-q1
InChIInChI=1S/C116H193N7O84/c1-25-56(144)70(158)77(165)107(177-25)202-94-54(122-32(8)142)105(189-45(21-135)92(94)200-111-81(169)74(162)60(148)36(12-126)182-111)195-91-44(20-134)191-116(99(83(91)171)207-106-55(123-33(9)143)95(203-108-78(166)71(159)57(145)26(2)178-108)93(46(22-136)190-106)201-112-82(170)75(163)61(149)37(13-127)183-112)205-97-64(152)48(192-114(85(97)173)199-90-42(18-132)186-102(51(67(90)155)119-29(5)139)194-86-39(15-129)179-100(174)49(65(86)153)117-27(3)137)24-176-115-98(76(164)62(150)47(193-115)23-175-101-50(118-28(4)138)66(154)87(40(16-130)185-101)196-109-79(167)72(160)58(146)34(10-124)180-109)206-104-53(121-31(7)141)69(157)89(43(19-133)188-104)198-113-84(172)96(63(151)38(14-128)184-113)204-103-52(120-30(6)140)68(156)88(41(17-131)187-103)197-110-80(168)73(161)59(147)35(11-125)181-110/h25-26,34-116,124-136,144-174H,10-24H2,1-9H3,(H,117,137)(H,118,138)(H,119,139)(H,120,140)(H,121,141)(H,122,142)(H,123,143)/t25-,26-,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+/m0/s1
InChIKeyZKCIHAKCRPKMRD-OGTZQYKZSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 91849765 (CHEBI:147959) 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)]-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)]Man(b1-4)GlcNAc(b1-4)GlcNAcSUBMITTER
Manual XrefsDatabases
G15522RVGlyGen
G15522RVGlyTouCan