input word = C00048785

Metabolite InformationStructural formula
Name Nagelamide N
(-)-Nagelamide N
Formula C13H16Br2N6O7S
Mw 557.91679344
CAS RN 1086468-03-2
C_ID C00048785 ,
InChIKey LATUGZRPHUSHHL-CJALPTNLNA-N
InChICode InChI=1S/C13H16Br2N6O7S/c14-6-3-7(19-8(6)15)9(22)17-4-5(10(23)24)13(11(25)20-12(16)21-13)18-1-2-29(26,27)28/h3,5,18-19H,1-2,4H2,(H,17,22)(H,23,24)(H,26,27,28)(H3,16,20,21,25)/t5-,13-/m0/s1
SMILES C1(=O)[C@@](NC(=N1)N)([C@@H](CNC(=O)c1[nH]c(c(c1)Br)Br)C(=O)O)NCCS(=O)(=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Lys
Organism
Kingdom Family Species Reference
AnimaliaAgelasidaeAgelas sp. Ref.
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OrganismAgelas sp.
ReferenceBlunt,Nat.Prod.Rep.,27,(2010),165