| Name |
Benzoyloxypaeoniflorin
Oxypaeoniflorin 6'-benzoate
beta-Benzoyloxypaeoniflorin |
| Formula |
C30H32O13 |
| Mw |
600.18429111 |
| CAS RN |
72896-40-3 |
| C_ID |
C00032759
, 
|
| InChIKey |
VIWQCBZFJFSCLC-YUDFALHANA-N |
| InChICode |
InChI=1S/C30H32O13/c1-27-13-29(37)19-11-30(27,28(19,26(42-27)43-29)14-39-24(36)16-7-9-17(31)10-8-16)41-25-22(34)21(33)20(32)18(40-25)12-38-23(35)15-5-3-2-4-6-15/h2-10,18-22,25-26,31-34,37H,11-14H2,1H3/t18-,19-,20-,21+,22-,25+,26-,27?,28+,29-,30+/m1/s1 |
| SMILES |
C[C@]12C[C@@]3(O)O[C@@H](O1)[C@]1(COC(=O)c4ccc(O)cc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Paeoniaceae | Paeonia suffruticosa ANDREWS  | Ref. |
| Plantae | Rutaceae | Phellodendron amurense | Ref. |
|
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