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CHEBI:152125 - CID 91850387
| Formula | C124H208N8O90 |
| Net Charge | 0 |
| Average Mass | 3250.994 |
| Monoisotopic Mass | 3249.19451 |
| 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]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]7O[C@H](CO)[C@@H](O[C@@H]8O[C@H](CO)[C@H](O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7NC(C)=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](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]7O[C@H](CO)[C@@H](O[C@@H]8O[C@H](CO)[C@H](O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7NC(C)=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]2O)[C@@H]1O |
| WURCS | WURCS=2.0/6,18,17/[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][a1221m-1a_1-5]/1-2-3-4-2-5-2-5-2-5-4-2-5-2-5-2-5-6/a4-b1_a6-r1_b4-c1_c3-d1_c6-k1_d2-e1_e4-f1_f3-g1_g4-h1_h3-i1_i4-j1_k2-l1_l4-m1_m3-n1_n4-o1_o3-p1_p4-q1 |
| InChI | InChI=1S/C124H208N8O90/c1-28-62(158)80(176)85(181)115(191-28)189-26-38(157)93(63(159)37(10-133)125-29(2)149)208-108-55(126-30(3)150)73(169)100(49(21-144)200-108)215-122-92(188)105(220-124-107(84(180)67(163)42(14-137)199-124)222-114-61(132-36(9)156)79(175)99(53(25-148)206-114)214-121-91(187)104(71(167)46(18-141)197-121)219-112-59(130-34(7)154)77(173)97(51(23-146)204-112)212-119-89(185)102(69(165)44(16-139)195-119)217-110-57(128-32(5)152)75(171)95(48(20-143)202-110)210-117-87(183)82(178)65(161)40(12-135)193-117)72(168)54(207-122)27-190-123-106(83(179)66(162)41(13-136)198-123)221-113-60(131-35(8)155)78(174)98(52(24-147)205-113)213-120-90(186)103(70(166)45(17-140)196-120)218-111-58(129-33(6)153)76(172)96(50(22-145)203-111)211-118-88(184)101(68(164)43(15-138)194-118)216-109-56(127-31(4)151)74(170)94(47(19-142)201-109)209-116-86(182)81(177)64(160)39(11-134)192-116/h28,37-124,133-148,157-188H,10-27H2,1-9H3,(H,125,149)(H,126,150)(H,127,151)(H,128,152)(H,129,153)(H,130,154)(H,131,155)(H,132,156)/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-,110-,111-,112-,113-,114-,115+,116-,117-,118-,119-,120-,121-,122-,123-,124+/m0/s1 |
| InChIKey | JWADSBPESFCSPK-OTTZWDNMSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| CID 91850387 (CHEBI:152125) is a polysaccharide (CHEBI:18154) |