input word = C00048604

Metabolite InformationStructural formula
Name Aplicyanin F
(+)-Aplicyanin F
Formula C15H16Br2N4O2
Mw 441.96400158
CAS RN 936633-64-6
C_ID C00048604 ,
InChIKey NWRCBLLWFSPUMF-UHFFFAOYNA-N
InChICode InChI=1S/C15H16Br2N4O2/c1-8(22)19-15-18-4-3-13(20-15)10-7-21(23-2)14-6-12(17)11(16)5-9(10)14/h5-7,13H,3-4H2,1-2H3,(H2,18,19,20,22)/t13-/m1/s1
SMILES c1(c(cc2c(c1)n(cc2[C@@H]1NC(=NCC1)NC(=O)C)OC)Br)Br
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
AnimaliaPolyclinidaeAplidium cyaneum Ref.
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OrganismAplidium cyaneum
ReferenceBlunt,Nat.Prod.Rep.,27,(2010),165