| Name |
Quinquenoside R1 |
| Formula |
C56H94O24 |
| Mw |
1150.61350393 |
| CAS RN |
85013-02-1 |
| C_ID |
C00031120
, 
|
| InChIKey |
JXRIVFVBUUJAGK-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C56H94O24/c1-25(2)12-10-16-55(9,80-49-45(71)41(67)38(64)30(77-49)24-73-47-43(69)39(65)35(61)27(21-57)74-47)56-17-11-15-54(56,8)53(7)19-13-31-51(4,5)34(14-18-52(31,6)32(53)20-33(56)60)78-50-46(42(68)36(62)28(22-58)75-50)79-48-44(70)40(66)37(63)29(76-48)23-72-26(3)59/h12,27-50,57-58,60-71H,10-11,13-24H2,1-9H3/t27-,28+,29-,30-,31-,32+,33-,34+,35-,36+,37-,38-,39-,40-,41+,42+,43+,44+,45+,46-,47-,48-,49+,50-,52+,53-,54+,55+,56+/m0/s1 |
| SMILES |
C1[C@H](C([C@H]2[C@@](C1)([C@@H]1[C@](CC2)([C@@]2([C@]([C@H](C1)O)(CCC2)[C@@](C)(CCC=C(C)C)O[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)CO[C@H]1O[C@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)O)O)O)C)C)C)(C)C)O[C@@H]1O[C@@H]([C@H]([C@H]([C@@H]1O[C@@H]1O[C@H]([C@@H]([C@@H]([C@H]1O)O)O)COC(=O)C)O)O)CO |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Araliaceae | Panax ginseng C.A.Meyer  | Ref. |
| Plantae | Araliaceae | Panax notoginseng | Ref. |
| Plantae | Araliaceae | Panax quinquefolium | Ref. |
|
|
zoom in
| Organism | Panax notoginseng |
|---|
| Reference | Wang,J.Nat.Med.,60,(2006),97 |
|---|
|
