input word = C00039843

Metabolite InformationStructural formula
Name Nepetanudone
(+)-Nepetanudone
Formula C20H24O4
Mw 328.16745925
CAS RN 142203-62-1
C_ID C00039843 ,
InChIKey KESCUBFFLAUUPO-QPTWUYTANA-N
InChICode InChI=1S/C20H24O4/c1-9-5-7-13-11(3)16-20-10(2)6-8-14(20)12(4)15(23-18(20)22)19(9,13)17(21)24-16/h9-10,15-16H,5-8H2,1-4H3/t9-,10-,15-,16+,19-,20+/m0/s1
SMILES [C@@]123C(=C([C@H]([C@]45C(=C([C@@H]1OC5=O)C)CC[C@@H]4C)OC3=O)C)CC[C@@H]2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeNepeta parnassica Ref.
zoom in