input word = C00042458

Metabolite InformationStructural formula
Name Dehydroxycubebin
(-)-Dehydroxycubebin
Formula C20H20O5
Mw 340.13107375
CAS RN 81410-45-9
C_ID C00042458 ,
InChIKey VJRFPARLIPMNRA-MNSHXRSINA-N
InChICode InChI=1S/C20H20O5/c1-3-17-19(24-11-22-17)7-13(1)5-15-9-21-10-16(15)6-14-2-4-18-20(8-14)25-12-23-18/h1-4,7-8,15-16H,5-6,9-12H2/t15-,16-/m0/s1
SMILES [C@H]1([C@H](COC1)Cc1cc2c(cc1)OCO2)Cc1ccc2c(c1)OCO2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeHypoestes purpurea Ref.
PlantaeRutaceaeBoronella koniambiensis Ref.
zoom in



OrganismHypoestes purpurea
ReferenceShen,J.Nat.Prod.,67,(2004),1947