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CHEBI:147999 - CID 91846466
| Formula | C102H172N6O75 |
| Net Charge | 0 |
| Average Mass | 2682.465 |
| Monoisotopic Mass | 2680.98295 |
| 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]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)[C@H]5O)[C@H](O)[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](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](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]/1-2-3-4-2-5-2-5-4-2-5-2-5-5-6/a4-b1_a6-o1_b4-c1_c3-d1_c6-i1_d2-e1_d6-g1_e4-f1_g4-h1_i2-j1_i4-l1_j4-k1_l4-m1_m3-n1 |
| InChI | InChI=1S/C102H172N6O75/c1-23-50(128)64(142)70(148)94(159-23)156-20-31(127)78(51(129)30(8-109)103-24(2)121)173-90-46(105-26(4)123)60(138)83(40(17-118)166-90)179-100-77(155)86(181-102-87(182-92-48(107-28(6)125)62(140)80(38(15-116)168-92)176-96-72(150)66(144)53(131)33(10-111)161-96)69(147)56(134)43(172-102)21-157-89-45(104-25(3)122)59(137)79(37(14-115)165-89)175-95-71(149)65(143)52(130)32(9-110)160-95)58(136)44(171-100)22-158-101-88(183-93-49(108-29(7)126)63(141)81(39(16-117)169-93)177-97-73(151)67(145)54(132)34(11-112)162-97)75(153)84(42(19-120)170-101)174-91-47(106-27(5)124)61(139)82(41(18-119)167-91)178-99-76(154)85(57(135)36(13-114)164-99)180-98-74(152)68(146)55(133)35(12-113)163-98/h23,30-102,109-120,127-155H,8-22H2,1-7H3,(H,103,121)(H,104,122)(H,105,123)(H,106,124)(H,107,125)(H,108,126)/t23-,30-,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 | WXLMFPYZFFQUOK-VMUGHWLSSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| CID 91846466 (CHEBI:147999) is a polysaccharide (CHEBI:18154) |