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CHEBI:150247 - CID 91848226

Default Structure
ChEBI IDCHEBI:150247
ChEBI NameCID 91848226
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC120H200N6O86
Net Charge0
Average Mass3102.876
Monoisotopic Mass3101.14611
SMILESCC(=O)N[C@@H]1[C@H](O[C@@H]2[C@@H](O[C@@H]3[C@H](O)[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)O[C@@H]4CO)O[C@H](CO[C@H]4O[C@H](CO[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]6O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]6O)[C@H]5NC(C)=O)[C@@H](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]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]3O)O[C@H](CO)[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]4O[C@@H](C)[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)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[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]/1-2-3-4-2-5-6-2-5-6-5-4-2-5-6-2-5-6/a4-b1_b4-c1_c3-d1_c6-l1_d2-e1_d4-h1_e3-f1_e4-g1_h3-i1_h4-j1_j2-k1_l2-m1_l6-p1_m3-n1_m4-o1_p3-q1_p4-r1
InChIInChI=1S/C120H200N6O86/c1-25-55(144)68(157)78(167)109(180-25)205-95-51(123-32(8)140)104(190-43(19-134)91(95)201-114-83(172)73(162)60(149)36(12-127)186-114)178-23-47-64(153)77(166)100(210-107-53(125-34(10)142)96(206-110-79(168)69(158)56(145)26(2)181-110)92(44(20-135)193-107)202-115-84(173)74(163)61(150)37(13-128)187-115)118(197-47)179-24-48-65(154)99(87(176)117(196-48)200-89-41(17-132)191-105(50(67(89)156)122-31(7)139)198-88-40(16-131)185-103(177)49(66(88)155)121-30(6)138)209-120-102(211-108-54(126-35(11)143)97(207-111-80(169)70(159)57(146)27(3)182-111)93(45(21-136)194-108)203-116-85(174)75(164)62(151)38(14-129)188-116)86(175)90(42(18-133)195-120)199-106-52(124-33(9)141)98(208-112-81(170)71(160)58(147)28(4)183-112)94(46(22-137)192-106)204-119-101(76(165)63(152)39(15-130)189-119)212-113-82(171)72(161)59(148)29(5)184-113/h25-29,36-120,127-137,144-177H,12-24H2,1-11H3,(H,121,138)(H,122,139)(H,123,140)(H,124,141)(H,125,142)(H,126,143)/t25-,26-,27-,28-,29-,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
InChIKeyNUSCBSLWCLKUJL-UAAFNCQSSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 91848226 (CHEBI:150247) is a carbohydrates and carbohydrate derivatives (CHEBI:78616)
Synonyms  Source
6-deoxy-alpha-L-galacto-hexopyranosyl-(1->2)-beta-D-galacto-hexopyranosyl-(1->4)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)-[beta-D-galacto-hexopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)]-alpha-D-manno-hexopyranosyl-(1->3)-[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->6)]-alpha-D-manno-hexopyranosyl-(1->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-D-gluco-hexopyranoseSUBMITTER
Fuc(a1-2)Gal(b1-4)[Fuc(a1-3)]GlcNAc(b1-4)[Fuc(a1-3)[Gal(b1-4)]GlcNAc(b1-2)]Man(a1-3)[Fuc(a1-3)[Gal(b1-4)]GlcNAc(b1-2)[Fuc(a1-3)[Gal(b1-4)]GlcNAc(b1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAcSUBMITTER
Manual XrefsDatabases
G38241TCGlyTouCan
G38241TCGlyGen