input word = C00047885

Metabolite InformationStructural formula
Name Flustramine J
(-)-Flustramine J
Formula C21H28Br2N2O
Mw 482.05683933
CAS RN 1187956-24-6
C_ID C00047885 ,
InChIKey PFOHXQUYBHBQAB-CRYJBYGPNA-N
InChICode InChI=1S/C21H28Br2N2O/c1-13(2)6-5-7-14(3)8-9-21-10-11-25(4)20(21)24-18-15(22)12-16(23)19(26)17(18)21/h6,8,12,20,24,26H,5,7,9-11H2,1-4H3/b14-8+/t20-,21-/m0/s1
SMILES CC(C)=CCC/C(C)=C/C[C@@]12CCN(C)[C@@H]1Nc1c(Br)cc(Br)c(O)c12
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
--Flustra foliacea Ref.
zoom in