| Name |
(-)-Simulanol |
| Formula |
C21H24O7 |
| Mw |
388.15220312 |
| CAS RN |
500574-38-9 |
| C_ID |
C00036289
, 
|
| InChIKey |
SGRRPSBKBJVKJE-WZTUFDKRNA-N |
| InChICode |
InChI=1S/C21H24O7/c1-25-16-9-13(10-17(26-2)19(16)24)20-15(11-23)14-7-12(5-4-6-22)8-18(27-3)21(14)28-20/h4-5,7-10,15,20,22-24H,6,11H2,1-3H3/b5-4+/t15-,20-/m0/s1 |
| SMILES |
COc1cc([C@@H]2Oc3c(OC)cc(/C=C/CO)cc3[C@H]2CO)cc(OC)c1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rutaceae | Zanthoxylum integrifoliolum | Ref. |
| Plantae | Rutaceae | Zanthoxylum simulans | Ref. |
|
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