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CHEBI:152619 - CID 91852228
| Formula | C115H190N8O84 |
| Net Charge | 0 |
| Average Mass | 3028.757 |
| Monoisotopic Mass | 3027.08418 |
| SMILES | CC(=O)N[C@H]1[C@H](O[C@@H]([C@H](O)[C@H](CO)NC(C)=O)[C@H](O)CO[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](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@]5(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O5)[C@H]4O)[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](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(C)=O)[C@H]([C@H](O)[C@H](O)CO)O6)[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](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@]5(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O5)[C@H]4O)[C@H]3NC(C)=O)[C@@H]2O)[C@@H]1O |
| WURCS | WURCS=2.0/7,15,14/[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][Aad21122h-2a_2-6_5*NCC/3=O][a1221m-1a_1-5]/1-2-3-4-2-5-6-2-5-6-4-2-5-6-7/a4-b1_a6-o1_b4-c1_c3-d1_c6-k1_d2-e1_d4-h1_e3-f1_f3-g2_h3-i1_i3-j2_k2-l1_l3-m1_m3-n2 |
| InChI | InChI=1S/C115H190N8O84/c1-28-62(152)76(166)78(168)103(182-28)180-26-44(151)84(63(153)37(13-124)116-29(2)137)193-99-58(120-33(6)141)75(165)85(52(24-135)190-99)195-104-80(170)93(74(164)54(192-104)27-181-108-97(77(167)67(157)45(17-128)189-108)200-101-60(122-35(8)143)88(69(159)47(19-130)184-101)197-106-82(172)95(72(162)50(22-133)187-106)206-114(111(176)177)11-39(146)56(118-31(4)139)91(203-114)65(155)42(149)15-126)199-109-98(201-102-61(123-36(9)144)89(70(160)48(20-131)185-102)198-107-83(173)96(73(163)51(23-134)188-107)207-115(112(178)179)12-40(147)57(119-32(5)140)92(204-115)66(156)43(150)16-127)79(169)86(53(25-136)191-109)194-100-59(121-34(7)142)87(68(158)46(18-129)183-100)196-105-81(171)94(71(161)49(21-132)186-105)205-113(110(174)175)10-38(145)55(117-30(3)138)90(202-113)64(154)41(148)14-125/h28,37-109,124-136,145-173H,10-27H2,1-9H3,(H,116,137)(H,117,138)(H,118,139)(H,119,140)(H,120,141)(H,121,142)(H,122,143)(H,123,144)(H,174,175)(H,176,177)(H,178,179)/t28-,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+,113-,114-,115-/m0/s1 |
| InChIKey | NEFLBGBPRWIKCY-BORRYYCFSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| CID 91852228 (CHEBI:152619) is a polysaccharide (CHEBI:18154) |