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CHEBI:148864 - CID 91860104
| Formula | C102H172N6O74 |
| Net Charge | 0 |
| Average Mass | 2666.466 |
| Monoisotopic Mass | 2664.98803 |
| 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)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO[C@H]3O[C@H](CO[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](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]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](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@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](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]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H]2O)[C@@H]1O |
| WURCS | WURCS=2.0/6,15,14/[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][a1221m-1a_1-5]/1-2-3-4-2-5-2-6-5-4-2-6-5-2-5/a4-b1_b4-c1_c3-d1_c6-j1_d2-e1_d4-g1_e4-f1_g3-h1_g4-i1_j2-k1_j6-n1_k3-l1_k4-m1_n4-o1 |
| InChI | InChI=1S/C102H172N6O74/c1-23-50(128)62(140)69(147)94(157-23)178-84-48(107-29(7)125)92(166-41(19-119)82(84)176-98-73(151)66(144)55(133)35(13-113)161-98)172-81-40(18-118)168-102(88(75(81)153)182-91-47(106-28(6)124)61(139)79(38(16-116)165-91)174-97-72(150)65(143)54(132)34(12-112)160-97)180-86-58(136)44(169-100(76(86)154)175-80-39(17-117)164-90(46(60(80)138)105-27(5)123)171-77(32(127)10-110)52(130)31(9-109)103-25(3)121)22-156-101-87(68(146)57(135)43(170-101)21-155-89-45(104-26(4)122)59(137)78(37(15-115)163-89)173-96-71(149)64(142)53(131)33(11-111)159-96)181-93-49(108-30(8)126)85(179-95-70(148)63(141)51(129)24(2)158-95)83(42(20-120)167-93)177-99-74(152)67(145)56(134)36(14-114)162-99/h23-24,31-102,109-120,127-154H,9-22H2,1-8H3,(H,103,121)(H,104,122)(H,105,123)(H,106,124)(H,107,125)(H,108,126)/t23-,24-,31-,32+,33+,34+,35+,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+/m0/s1 |
| InChIKey | IFXUVJATWGTJES-NYEHTFMPSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| CID 91860104 (CHEBI:148864) is a polysaccharide (CHEBI:18154) |