input word = C00038723

Metabolite InformationStructural formula
Name Ceratinamine
Formula C13H15Br2N3O2
Mw 402.95310255
CAS RN 175993-07-4
C_ID C00038723 ,
InChIKey VLXGYEMZRIGDRH-UHFFFAOYSA-N
InChICode InChI=1S/C13H15Br2N3O2/c14-10-6-9(2-3-16)7-11(15)13(10)20-5-1-4-18-12(19)8-17/h6-7H,1-5,16H2,(H,18,19)
SMILES N#CC(=O)NCCCOc1c(Br)cc(CCN)cc1Br
Start Substs in Alk. Biosynthesis (Prediction) L-Lys
Organism
Kingdom Family Species Reference
AnimaliaDruinellidaeAplysinella sp. Ref.
--Pseudoceratina arabica Ref.
--Pseudoceratina purpurea Ref.
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OrganismPseudoceratina purpurea
ReferenceLacy,J.Nat.Prod.,63,(2000),119