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CHEBI:151634 - CID 91845311

Default Structure
ChEBI IDCHEBI:151634
ChEBI NameCID 91845311
Stars
Last Modified20 April 2021
SubmitterGareth Owen
DownloadsMolfile
FormulaC115H188N8O87
Net Charge0
Average Mass3074.738
Monoisotopic Mass3073.05327
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[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO[C@H]3O[C@H](CO)[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@]5(C(=O)O)C[C@H](O)[C@@H](NC(=O)CO)[C@H]([C@H](O)[C@H](O)CO)O5)[C@H](O)[C@H](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@]6(C(=O)O)C[C@H](O)[C@@H](NC(=O)CO)[C@H]([C@H](O)[C@H](O)CO)O6)[C@H]5O)[C@H](O)[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@]5(C(=O)O)C[C@H](O)[C@@H](NC(=O)CO)[C@H]([C@H](O)[C@H](O)CO)O5)[C@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H]2O)[C@@H]1O
InChIInChI=1S/C115H188N8O87/c1-27-61(151)75(165)79(169)103(186-27)182-24-49-90(70(160)56(98(175)187-49)116-28(2)137)199-100-58(118-30(4)139)72(162)87(43(17-131)191-100)202-106-83(173)94(69(159)46(195-106)23-183-108-96(78(168)65(155)39(13-127)189-108)205-101-59(119-31(5)140)73(163)85(41(15-129)192-101)200-104-80(170)76(166)66(156)47(196-104)25-184-113(110(176)177)7-33(142)53(121-50(148)20-134)91(207-113)62(152)36(145)10-124)204-109-97(206-102-60(120-32(6)141)74(164)86(42(16-130)193-102)201-105-81(171)77(167)67(157)48(197-105)26-185-114(111(178)179)8-34(143)54(122-51(149)21-135)92(208-114)63(153)37(146)11-125)82(172)89(45(19-133)194-109)198-99-57(117-29(3)138)71(161)88(44(18-132)190-99)203-107-84(174)95(68(158)40(14-128)188-107)210-115(112(180)181)9-35(144)55(123-52(150)22-136)93(209-115)64(154)38(147)12-126/h27,33-49,53-109,124-136,142-147,151-175H,7-26H2,1-6H3,(H,116,137)(H,117,138)(H,118,139)(H,119,140)(H,120,141)(H,121,148)(H,122,149)(H,123,150)(H,176,177)(H,178,179)(H,180,181)/t27-,33-,34-,35-,36+,37+,38+,39+,40+,41+,42+,43+,44+,45+,46+,47+,48+,49+,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+,113+,114+,115-/m0/s1
InChIKeyXGEYOHOLNCJZPV-LFIOQCABSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 91845311 (CHEBI:151634) is a carbohydrates and carbohydrate derivatives (CHEBI:78616)
Manual XrefsDatabases
G52383QHGlyTouCan
G52383QHGlyGen