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CHEBI:150386 - CID 91848280
| 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]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]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]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][a1221m-1a_1-5][a2112h-1b_1-5]/1-2-3-4-2-5-6-2-6-4-2-5-6-2-6/a4-b1_b4-c1_c3-d1_c6-j1_d4-e1_d6-h1_e3-f1_e4-g1_h4-i1_j2-k1_j6-n1_k3-l1_k4-m1_n4-o1 |
| InChI | InChI=1S/C102H172N6O74/c1-23-50(127)62(139)70(147)94(158-23)179-85-48(107-29(7)124)92(167-40(18-118)83(85)177-98-74(151)66(143)55(132)35(13-113)162-98)173-82-44(22-156-90-46(105-27(5)122)60(137)80(38(16-116)165-90)175-97-73(150)65(142)54(131)34(12-112)161-97)171-100(76(153)69(82)146)181-87-58(135)43(169-101(77(87)154)176-81-39(17-117)166-91(47(61(81)138)106-28(6)123)172-78(32(126)10-110)52(129)31(9-109)103-25(3)120)21-157-102-88(68(145)57(134)42(170-102)20-155-89-45(104-26(4)121)59(136)79(37(15-115)164-89)174-96-72(149)64(141)53(130)33(11-111)160-96)182-93-49(108-30(8)125)86(180-95-71(148)63(140)51(128)24(2)159-95)84(41(19-119)168-93)178-99-75(152)67(144)56(133)36(14-114)163-99/h23-24,31-102,109-119,126-154H,9-22H2,1-8H3,(H,103,120)(H,104,121)(H,105,122)(H,106,123)(H,107,124)(H,108,125)/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 | QYZFBEUOETVANQ-BHHAXQJFSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| CID 91848280 (CHEBI:150386) is a carbohydrates and carbohydrate derivatives (CHEBI:78616) |