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CHEBI:155728 - CID 91851889
| Formula | C104H175N7O76 |
| Net Charge | 0 |
| Average Mass | 2739.517 |
| Monoisotopic Mass | 2738.00441 |
| 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]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]5NC(C)=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]2O)[C@@H]1O |
| WURCS | WURCS=2.0/5,15,14/[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]/1-2-3-4-2-5-2-5-4-2-5-2-5-2-5/a4-b1_b4-c1_c3-d1_c6-i1_d4-e1_d6-g1_e4-f1_g4-h1_i2-j1_i6-n1_j4-k1_k3-l1_l4-m1_n4-o1 |
| InChI | InChI=1S/C104H175N7O76/c1-24(125)105-31(8-112)53(133)80(32(132)9-113)177-93-49(108-27(4)128)63(143)86(42(19-123)170-93)184-103-79(159)89(186-101-77(157)72(152)87(178-94-50(109-28(5)129)64(144)83(40(17-121)171-94)181-99-75(155)69(149)56(136)35(12-116)165-99)46(176-101)23-161-92-48(107-26(3)127)62(142)82(39(16-120)169-92)180-98-74(154)68(148)55(135)34(11-115)164-98)60(140)45(174-103)22-162-104-90(71(151)58(138)44(175-104)21-160-91-47(106-25(2)126)61(141)81(38(15-119)168-91)179-97-73(153)67(147)54(134)33(10-114)163-97)187-96-52(111-30(7)131)66(146)85(43(20-124)173-96)183-102-78(158)88(59(139)37(14-118)167-102)185-95-51(110-29(6)130)65(145)84(41(18-122)172-95)182-100-76(156)70(150)57(137)36(13-117)166-100/h31-104,112-124,132-159H,8-23H2,1-7H3,(H,105,125)(H,106,126)(H,107,127)(H,108,128)(H,109,129)(H,110,130)(H,111,131)/t31-,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-,103-,104-/m0/s1 |
| InChIKey | DGMVWOTXVAGZBR-YMYCZUMFSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| CID 91851889 (CHEBI:155728) is a carbohydrates and carbohydrate derivatives (CHEBI:78616) |