input word = C00048602

Metabolite InformationStructural formula
Name Aplicyanin D
Formula C15H17BrN4O2
Mw 364.05348872
CAS RN 936633-62-4
C_ID C00048602 ,
InChIKey PNPNLBSBVMICFT-UHFFFAOYNA-N
InChICode InChI=1S/C15H17BrN4O2/c1-9(21)18-15-17-6-5-13(19-15)12-8-20(22-2)14-4-3-10(16)7-11(12)14/h3-4,7-8,13H,5-6H2,1-2H3,(H2,17,18,19,21)/t13-/m0/s1
SMILES c1c(cc2c(c1)n(cc2[C@H]1NC(=NCC1)NC(=O)C)OC)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