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CHEBI:150566 - CID 91858608
| Formula | C102H172N6O73 |
| Net Charge | 0 |
| Average Mass | 2650.467 |
| Monoisotopic Mass | 2648.99312 |
| SMILES | CC(=O)N[C@@H]1[C@H](O[C@@H]2[C@@H](O[C@@H]3[C@H](O)[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[C@@H]5O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]5O)O[C@@H]4CO)O[C@H](CO[C@H]4O[C@H](CO[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]6O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]6O)[C@H]5NC(C)=O)[C@@H](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]5O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]5O)[C@H]4NC(C)=O)[C@H]3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(C)=O)O[C@H](CO)[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]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]/1-2-3-4-2-5-2-4-2-6-5-2-6-5-6/a4-b1_a6-o1_b4-c1_c3-d1_c4-g1_c6-h1_d2-e1_e4-f1_h2-i1_h6-l1_i3-j1_i4-k1_l3-m1_l4-n1 |
| InChI | InChI=1S/C102H172N6O73/c1-23-50(126)63(139)71(147)94(157-23)154-20-33(125)78(53(129)32(10-109)103-26(4)119)171-91-46(105-28(6)121)61(137)80(40(17-116)166-91)173-100-77(153)86(179-102-88(69(145)58(134)38(15-114)164-102)181-92-47(106-29(7)122)62(138)79(39(16-115)167-92)172-97-74(150)66(142)55(131)35(12-111)161-97)83(174-90-45(104-27(5)120)60(136)54(130)34(11-110)160-90)44(170-100)22-156-101-87(180-93-49(108-31(9)124)85(178-96-73(149)65(141)52(128)25(3)159-96)82(42(19-118)168-93)176-99-76(152)68(144)57(133)37(14-113)163-99)70(146)59(135)43(169-101)21-155-89-48(107-30(8)123)84(177-95-72(148)64(140)51(127)24(2)158-95)81(41(18-117)165-89)175-98-75(151)67(143)56(132)36(13-112)162-98/h23-25,32-102,109-118,125-153H,10-22H2,1-9H3,(H,103,119)(H,104,120)(H,105,121)(H,106,122)(H,107,123)(H,108,124)/t23-,24-,25-,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 | PNJOWFJHJJGFNM-YDHNQQRLSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| CID 91858608 (CHEBI:150566) is a carbohydrates and carbohydrate derivatives (CHEBI:78616) |