Name |
Acetylvalerenolic acid |
Formula |
C17H24O4 |
Mw |
292.16745925 |
CAS RN |
84638-55-1 |
C_ID |
C00021292
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InChIKey |
VBBXZFLAYWAXSK-IVGPXLMUNA-N |
InChICode |
InChI=1S/C17H24O4/c1-9-5-6-13(7-11(3)17(19)20)15-10(2)8-14(16(9)15)21-12(4)18/h7,9,13-14,16H,5-6,8H2,1-4H3,(H,19,20)/b11-7+/t9-,13+,14-,16+/m1/s1 |
SMILES |
C1C[C@H]([C@@H]2C(=C(C[C@H]2OC(=O)C)C)[C@@H]1/C=C(/C(=O)O)\C)C |
Start Substs in Alk. Biosynthesis (Prediction) |
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Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Valerianaceae/Linnaeaceae/Dipsacaceae/Diervillaceae | Valeriana officinalis | Ref. |
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Organism | Valeriana officinalis | Reference | Stoll,Justus Liebigs Ann. Chem.,603,(1957),158 |
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