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CHEBI:147644 - CID 91857777
| Formula | C105H176N6O76 |
| Net Charge | 0 |
| Average Mass | 2738.529 |
| Monoisotopic Mass | 2737.00916 |
| 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]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@]5(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O5)[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=2.0/7,15,14/[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][Aad21122h-2a_2-6_5*NCC/3=O][a1221m-1a_1-5]/1-2-3-4-2-5-6-2-7-5-4-2-7-5-7/a4-b1_a6-o1_b4-c1_c3-d1_c6-k1_d2-e1_d4-h1_e4-f1_f6-g2_h3-i1_h4-j1_k2-l1_l3-m1_l4-n1 |
| InChI | InChI=1S/C105H176N6O76/c1-24-52(131)64(143)71(150)95(163-24)160-21-36(130)79(55(134)33(11-112)106-27(4)122)176-91-48(108-29(6)124)62(141)81(41(17-118)169-91)179-101-78(157)88(61(140)45(174-101)22-161-102-89(70(149)59(138)39(15-116)168-102)185-94-51(111-32(9)127)87(183-97-73(152)66(145)54(133)26(3)165-97)84(44(20-121)172-94)181-99-75(154)68(147)58(137)38(14-115)167-99)184-103-90(77(156)82(42(18-119)173-103)177-93-50(110-31(8)126)86(182-96-72(151)65(144)53(132)25(2)164-96)83(43(19-120)171-93)180-98-74(153)67(146)57(136)37(13-114)166-98)186-92-49(109-30(7)125)63(142)80(40(16-117)170-92)178-100-76(155)69(148)60(139)46(175-100)23-162-105(104(158)159)10-34(128)47(107-28(5)123)85(187-105)56(135)35(129)12-113/h24-26,33-103,112-121,128-157H,10-23H2,1-9H3,(H,106,122)(H,107,123)(H,108,124)(H,109,125)(H,110,126)(H,111,127)(H,158,159)/t24-,25-,26-,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-,103+,105+/m0/s1 |
| InChIKey | NHXHGYYHEBCTGH-GUCVKKOPSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| CID 91857777 (CHEBI:147644) is a polysaccharide (CHEBI:18154) |