input word = C00026863

Metabolite InformationStructural formula
Name Akashin A
Formula C22H19Cl2N3O5
Mw 475.07017616
CAS RN 428516-77-2
C_ID C00026863 ,
InChIKey KHBPQPUZXNFKKR-YEBCZMPUNA-N
InChICode InChI=1S/C22H19Cl2N3O5/c1-8-15(25)20(30)21(31)22(32-8)27-14-5-3-10(24)7-12(14)19(29)17(27)16-18(28)11-6-9(23)2-4-13(11)26-16/h2-8,15,20-22,26,30-31H,25H2,1H3/b17-16+/t8-,15-,20+,21-,22-/m0/s1
SMILES C[C@@H]1OC(N2/C(=C3/Nc4ccc(Cl)cc4C3=O)C(=O)c3cc(Cl)ccc32)[C@@H](O)[C@H](O)[C@H]1N
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp.GW48-1497 Ref.
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