input word = C00042637

Metabolite InformationStructural formula
Name Isoptilocaulin
Formula C15H25N3
Mw 247.20484782
CAS RN 78777-03-4
C_ID C00042637 ,
InChIKey OJHZDBGRMGYWJG-UHFFFAOYNA-N
InChICode InChI=1S/C15H25N3/c1-3-4-5-11-9(2)8-10-6-7-12-13(10)14(11)18-15(16)17-12/h10,12-14H,3-8H2,1-2H3,(H3,16,17,18)/t10-,12-,13-,14+/m1/s1
SMILES C1(=C([C@H]2[C@@H]3[C@@H](C1)CC[C@H]3NC(=N2)N)CCCC)C
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
AnimaliaAxinellidaePtilocaulis sp. Ref.
--Batzella sp. Ref.
--Monanchora unguifera Ref.
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OrganismPtilocaulis sp.
ReferenceBlunt,Nat.Prod.Rep.,27,(2010),165