input word = C00016063

Metabolite InformationStructural formula
Name Blasticidin S
Bla-S
Formula C17H26N8O5
Mw 422.202616
CAS RN 2079-00-7
C_ID C00016063 ,
InChIKey CXNPLSGKWMLZPZ-KJSKTHJBNA-N
InChICode InChI=1S/C17H26N8O5/c1-24(16(20)21)6-4-9(18)8-12(26)22-10-2-3-13(30-14(10)15(27)28)25-7-5-11(19)23-17(25)29/h2-3,5,7,9-10,13-14H,4,6,8,18H2,1H3,(H3,20,21)(H,22,26)(H,27,28)(H2,19,23,29)/t9-,10-,13-,14-/m0/s1
SMILES n1c(ccn(c1=O)[C@@H]1C=C[C@@H]([C@H](O1)C(=O)O)NC(=O)C[C@H](CCN(C(=N)N)C)N)N
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces griseochromogenes Ref.
BacteriaStreptomycetaceaeStreptomyces sp. HK1-0052 Ref.
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OrganismStreptomyces sp. HK1-0052
ReferenceNeumann,Nat.Prod.Lett.,8,(1996),137