| Name |
Polygalasaponin II |
| Formula |
C48H78O19 |
| Mw |
958.51373031 |
| CAS RN |
162857-62-7 |
| C_ID |
C00041778
, 
|
| InChIKey |
IYMDTUUDLAHXGD-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C48H78O19/c1-21-29(53)32(56)35(59)39(62-21)65-37-34(58)31(55)26(19-50)64-41(37)67-42(61)48-14-12-43(2,3)16-23(48)22-8-9-28-44(4)17-24(52)38(66-40-36(60)33(57)30(54)25(18-49)63-40)45(5,20-51)27(44)10-11-47(28,7)46(22,6)13-15-48/h8,21,23-41,49-60H,9-20H2,1-7H3/t21-,23-,24+,25+,26-,27-,28+,29-,30+,31+,32+,33+,34+,35-,36-,37-,38-,39+,40-,41+,44+,45-,46-,47+,48-/m0/s1 |
| SMILES |
C1[C@@H]2[C@](CCC1(C)C)(CC[C@]1(C2=CC[C@H]2[C@]1(CC[C@H]1[C@]2(C[C@H]([C@@H]([C@@]1(C)CO)O[C@@H]1O[C@@H]([C@H]([C@H]([C@@H]1O)O)O)CO)O)C)C)C)C(=O)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)C)O)O)O)O)O)CO |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Polygalaceae | Polygala japonica | Ref. |
|
|
zoom in
| Organism | Polygala japonica |
|---|
| Reference | Li,J.Nat.Prod.,69,(2006),591 |
|---|
|
