| Name |
Benzoylpaeoniflorin |
| Formula |
C30H32O12 |
| Mw |
584.18937649 |
| CAS RN |
38642-49-8 |
| C_ID |
C00044106
, 
|
| InChIKey |
LATYEZNGPQKAIK-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C30H32O12/c1-27-14-29(36)19-12-30(27,28(19,26(41-27)42-29)15-38-24(35)17-10-6-3-7-11-17)40-25-22(33)21(32)20(31)18(39-25)13-37-23(34)16-8-4-2-5-9-16/h2-11,18-22,25-26,31-33,36H,12-15H2,1H3/t18-,19+,20+,21+,22-,25+,26+,27-,28-,29+,30-/m1/s1 |
| SMILES |
[C@@H]1(O[C@H]([C@@H]([C@H]([C@H]1O)O)O)O[C@]12[C@@]3(O[C@@H]4[C@]1([C@@H]([C@](O4)(O)C3)C2)COC(=O)c1ccccc1)C)COC(=O)c1ccccc1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Paeoniaceae | Paeonia peregrina | Ref. |
|
|
zoom in
| Organism | Paeonia peregrina |
|---|
| Reference | Kostova,Phytochem.,48,(1998),511 |
|---|
|
