| Name |
Obacunoic acid
Obacunonic acid |
| Formula |
C26H32O8 |
| Mw |
472.209718 |
| CAS RN |
751-29-1 |
| C_ID |
C00033259
, 
|
| InChIKey |
GUIYORVNNIUEBH-UXFDAEAJNA-N |
| InChICode |
InChI=1S/C26H32O8/c1-22(2,31)16-12-17(27)25(5)15(23(16,3)9-7-18(28)29)6-10-24(4)19(14-8-11-32-13-14)33-21(30)20-26(24,25)34-20/h7-9,11,13,15-16,19-20,31H,6,10,12H2,1-5H3,(H,28,29)/b9-7+/t15-,16+,19+,20-,23+,24+,25+,26-/m1/s1 |
| SMILES |
CC(C)(O)[C@@H]1CC(=O)[C@]2(C)[C@H](CC[C@@]3(C)[C@H](c4ccoc4)OC(=O)[C@H]4O[C@]432)[C@@]1(C)/C=C/C(=O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rutaceae | Citrus sinensis  | Ref. |
| Plantae | Rutaceae | Citrus sudachi | Ref. |
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