input word = C00019829

Metabolite InformationStructural formula
Name 5-Deoxyprotobruceol II regioisomer
Formula C19H20O5
Mw 328.13107375
CAS RN 156547-94-3
C_ID C00019829 ,
InChIKey JYTYDMHUCUHCFK-ONNFQVAWNA-N
InChICode InChI=1S/C19H20O5/c1-18(2,24-21)10-4-11-19(3)12-9-14-15(23-19)7-5-13-6-8-16(20)22-17(13)14/h4-10,12,21H,11H2,1-3H3/b10-4+/t19-/m0/s1
SMILES CC(C)(/C=C/CC1(C)C=Cc2c(ccc3ccc(=O)oc23)O1)OO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeBoronia lanceolata Ref.
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