input word = C00018502

Metabolite InformationStructural formula
Name Naphthomycin B
Formula C39H44ClNO9
Mw 705.27045972
CAS RN 86825-88-9
C_ID C00018502 ,
InChIKey PGLCKEFYXCGUGA-VIXXKOKXNA-N
InChICode InChI=1S/C39H44ClNO9/c1-20-11-9-7-8-10-12-30(45)41-34-33(40)39(50)31-27(38(34)49)18-25(6)37(48)32(31)36(47)24(5)17-23(4)35(46)22(3)14-16-26(42)15-13-21(2)29(44)19-28(20)43/h7-14,16-18,20,22-23,26,28,35,42-43,46,48H,15,19H2,1-6H3,(H,41,45)/b8-7+,11-9-,12-10-,16-14+,21-13+,24-17-/t20-,22+,23+,26+,28+,35+/m1/s1
SMILES c12c3cc(c(c1C(=O)/C(=C\[C@@H]([C@H]([C@H](/C=C/[C@H](C/C=C(/C(=O)C[C@@H]([C@@H](/C=C\C=C\C=C/C(=O)NC(=C(C2=O)Cl)C3=O)C)O)\C)O)C)O)C)/C)O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Asp
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces diastatochromogenes var. diastatochromogenes T.1892 Ref.
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