input word = C00057844

Metabolite InformationStructural formula
Name Volvalerenone A
Formula C14H20O4
Mw 252.13615913
CAS RN 1254950-18-9
C_ID C00057844
InChIKey GWRCZEGABJXNOQ-DSMZTOPNSA-N
InChICode InChI=1S/C14H20O4/c1-8-4-5-9-10-12(2,6-7-14(8,10)17)18-13(3,16)11(9)15/h8,16-17H,4-7H2,1-3H3/t8-,12+,13-,14-/m1/s1
SMILES C[C@@H]1CCC2=C3[C@](C)(CC[C@]31O)O[C@@](C)(O)C2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeValerianaceae/Linnaeaceae/Dipsacaceae/DiervillaceaeValeriana officinalis Ref.
zoom in