| Name |
Monovalerianester A |
| Formula |
C15H22O7 |
| Mw |
314.13655306 |
| CAS RN |
1225016-09-0 |
| C_ID |
C00056956
|
| InChIKey |
KXVMVLPGAKJUSG-SPJHXALWSA-N |
| InChICode |
InChI=1S/C15H22O7/c1-7(2)3-9(18)21-14-11-10(8(4-16)5-20-14)12-13(22-12)15(11,19)6-17/h5,7,10-14,16-17,19H,3-4,6H2,1-2H3/t10-,11-,12+,13+,14+,15-/m1/s1 |
| SMILES |
OCC1=CO[C@@H](OC(CC(C)C)=O)[C@@]2([H])[C@]1([H])[C@@]3([H])[C@@](O3)([H])[C@]2(CO)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Valerianaceae/Linnaeaceae/Dipsacaceae/Diervillaceae | Valeriana officinalis  | Ref. |
|
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