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CHEBI:152979 - CID 91854847
| Formula | C110H185N7O80 |
| Net Charge | 0 |
| Average Mass | 2885.659 |
| Monoisotopic Mass | 2884.06232 |
| 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]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](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]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=2.0/6,16,15/[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]/1-2-3-4-2-5-2-5-2-5-4-2-5-2-5-6/a4-b1_a6-p1_b4-c1_c3-d1_c6-k1_d2-e1_d4-g1_d6-i1_e4-f1_g4-h1_i4-j1_k2-l1_k6-n1_l4-m1_n4-o1 |
| InChI | InChI=1S/C110H185N7O80/c1-25-55(138)70(153)77(160)102(172-25)168-21-34(137)85(56(139)33(9-118)111-26(2)130)187-98-51(114-29(5)133)66(149)91(45(20-129)180-98)194-108-84(167)93(63(146)47(184-108)23-171-109-94(196-100-53(116-31(7)135)68(151)89(43(18-127)182-100)192-106-81(164)74(157)60(143)38(13-122)176-106)76(159)62(145)46(185-109)22-169-96-49(112-27(3)131)64(147)86(40(15-124)178-96)189-103-78(161)71(154)57(140)35(10-119)173-103)195-110-95(197-101-54(117-32(8)136)69(152)90(44(19-128)183-101)193-107-82(165)75(158)61(144)39(14-123)177-107)83(166)92(188-99-52(115-30(6)134)67(150)88(42(17-126)181-99)191-105-80(163)73(156)59(142)37(12-121)175-105)48(186-110)24-170-97-50(113-28(4)132)65(148)87(41(16-125)179-97)190-104-79(162)72(155)58(141)36(11-120)174-104/h25,33-110,118-129,137-167H,9-24H2,1-8H3,(H,111,130)(H,112,131)(H,113,132)(H,114,133)(H,115,134)(H,116,135)(H,117,136)/t25-,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-,104-,105-,106-,107-,108-,109-,110+/m0/s1 |
| InChIKey | ATWRHCVPOXZNPA-RDNQXVSRSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| CID 91854847 (CHEBI:152979) is a polysaccharide (CHEBI:18154) |