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CHEBI:155166 - CID 91862288
| Formula | C118H198N8O86 |
| Net Charge | 0 |
| Average Mass | 3104.852 |
| Monoisotopic Mass | 3103.13661 |
| SMILES | CC(=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]([C@H](O)[C@H](CO)NC(C)=O)[C@H](O)CO)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]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)[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]5O)[C@H](O)[C@H]4NC(C)=O)[C@@H]3O)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]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]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 |
| WURCS | WURCS=2.0/5,17,16/[h2122h_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2112h-1b_1-5]/1-2-3-4-2-5-2-5-4-2-5-2-5-2-5-2-5/a4-b1_b4-c1_c3-d1_c6-i1_d2-e1_d4-g1_e4-f1_g4-h1_i2-j1_i6-n1_j4-k1_k3-l1_l4-m1_n4-o1_o3-p1_p4-q1 |
| InChI | InChI=1S/C118H198N8O86/c1-27(143)119-35(9-127)60(152)89(36(151)10-128)199-104-54(121-29(3)145)70(162)96(48(22-140)190-104)207-116-88(180)100(210-118-102(212-109-59(126-34(8)150)74(166)94(47(21-139)195-109)204-113-84(176)79(171)64(156)40(14-132)186-113)85(177)97(50(24-142)196-118)200-105-55(122-30(4)146)71(163)91(44(18-136)191-105)201-110-81(173)76(168)61(153)37(11-129)183-110)68(160)52(197-116)26-182-117-101(211-108-58(125-33(7)149)75(167)95(49(23-141)194-108)206-115-87(179)99(67(159)42(16-134)188-115)209-107-57(124-32(6)148)73(165)93(46(20-138)193-107)203-112-83(175)78(170)63(155)39(13-131)185-112)80(172)65(157)51(198-117)25-181-103-53(120-28(2)144)69(161)90(43(17-135)189-103)205-114-86(178)98(66(158)41(15-133)187-114)208-106-56(123-31(5)147)72(164)92(45(19-137)192-106)202-111-82(174)77(169)62(154)38(12-130)184-111/h35-118,127-142,151-180H,9-26H2,1-8H3,(H,119,143)(H,120,144)(H,121,145)(H,122,146)(H,123,147)(H,124,148)(H,125,149)(H,126,150)/t35-,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+/m0/s1 |
| InChIKey | NDXIEQDWURYPBF-KEEQRXGPSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| CID 91862288 (CHEBI:155166) is a carbohydrates and carbohydrate derivatives (CHEBI:78616) |