input word = C00027208

Metabolite InformationStructural formula
Name Crispine E
Formula C15H24N4O2
Mw 292.18992604
CAS RN 474304-20-6
C_ID C00027208 ,
InChIKey FRROOMGFBCWJRP-UHFFFAOYNA-N
InChICode InChI=1S/C15H24N4O2/c1-20-13-8-10-5-7-18-12(4-3-6-19-15(16)17)11(10)9-14(13)21-2/h8-9,12,18H,3-7H2,1-2H3,(H4,16,17,19)/t12-/m0/s1
SMILES c1c2c(cc(c1OC)OC)[C@@H](NCC2)CCCNC(=N)N
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCarduus crispus Ref.
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OrganismCarduus crispus
ReferenceZhang,Tetrahedron,58,(2002),6795