| Name |
Asparacoside |
| Formula |
C49H80O21 |
| Mw |
1004.51920962 |
| CAS RN |
671774-36-0 |
| C_ID |
C00043295
, 
|
| InChIKey |
GLLQBFOUGGRCKY-PLBSMOLZNA-N |
| InChICode |
InChI=1S/C49H80O21/c1-20-7-12-49(64-16-20)21(2)32-29(70-49)14-26-24-6-5-22-13-23(8-10-47(22,3)25(24)9-11-48(26,32)4)65-46-42(69-45-39(59)36(56)35(55)30(15-50)66-45)40(60)41(68-44-38(58)34(54)28(52)18-62-44)31(67-46)19-63-43-37(57)33(53)27(51)17-61-43/h20-46,50-60H,5-19H2,1-4H3/t20-,21+,22+,23+,24-,25+,26+,27+,28+,29+,30-,31-,32+,33+,34+,35+,36+,37+,38-,39-,40+,41-,42-,43+,44+,45+,46-,47+,48+,49-/m1/s1 |
| SMILES |
C1[C@H]2[C@H]([C@H]3[C@](C1)([C@@H]1[C@H](C3)O[C@]3([C@H]1C)OC[C@@H](CC3)C)C)CC[C@@H]1[C@@]2(CC[C@@H](C1)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O)O[C@H]1[C@@H]([C@H]([C@H](CO1)O)O)O)CO[C@@H]1OC[C@@H]([C@@H]([C@@H]1O)O)O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asparagaceae | Asparagus cochinchinensis  | Ref. |
|
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