input word = C00063654

Metabolite InformationStructural formula
Name Valeriananoid A
Formula C15H24O2
Mw 236.17763001
CAS RN 111931-58-9
C_ID C00063654
InChIKey XLZVKKAUANEKGL-UQXKVLDMSA-N
InChICode InChI=1S/C15H24O2/c1-9-5-6-15(17)13(2,3)11-7-10(9)14(15,4)8-12(11)16/h9-11,17H,5-8H2,1-4H3/t9-,10-,11-,14-,15+/m0/s1
SMILES CC1CCC2(O)C(C)(C)C3CC1C2(C)CC3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeValerianaceae/Linnaeaceae/Dipsacaceae/DiervillaceaeValeriana jatamansi Ref.
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