input word = C00048601

Metabolite InformationStructural formula
Name Aplicyanin C
Formula C13H15BrN4O
Mw 322.04292403
CAS RN 936633-61-3
C_ID C00048601 ,
InChIKey DPNGINHDMGCQAQ-UHFFFAOYNA-N
InChICode InChI=1S/C13H15BrN4O/c1-19-18-7-10(11-4-5-16-13(15)17-11)9-6-8(14)2-3-12(9)18/h2-3,6-7,11H,4-5H2,1H3,(H3,15,16,17)/t11-/m1/s1
SMILES c1c(cc2c(c1)n(cc2[C@@H]1NC(=NCC1)N)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