input word = C00048599

Metabolite InformationStructural formula
Name Aplicyanin A
(-)-Aplicyanin A
Formula C12H13BrN4
Mw 292.03235934
CAS RN 936633-59-9
C_ID C00048599 ,
InChIKey VVONRGQMZKFFRP-UHFFFAOYNA-N
InChICode InChI=1S/C12H13BrN4/c13-7-1-2-10-8(5-7)9(6-16-10)11-3-4-15-12(14)17-11/h1-2,5-6,11,16H,3-4H2,(H3,14,15,17)/t11-/m0/s1
SMILES c1c(cc2c(c1)[nH]cc2[C@H]1NC(=NCC1)N)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