input word = C00027205

Metabolite InformationStructural formula
Name Crispine B
Carcrisine A
Formula C14H16NO2
Mw 230.11810376
CAS RN 474304-17-1
C_ID C00027205 ,
InChIKey BHUXEEVRLQFWKE-UHFFFAOYSA-N
InChICode InChI=1S/C14H16NO2/c1-16-13-8-10-5-7-15-6-3-4-12(15)11(10)9-14(13)17-2/h5,7-9H,3-4,6H2,1-2H3/q+1
SMILES c1c2c(cc(c1OC)OC)cc[n+]1c2CCC1
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCarduus crispus Ref.
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OrganismCarduus crispus
ReferenceZhang,Tetrahedron,58,(2002),6795