input word = C00015234

Metabolite InformationStructural formula
Name 34a-Deoxyrifamycin W
Formula C35H45NO10
Mw 639.30434667
CAS RN 442871-33-2
C_ID C00015234 ,
InChIKey VFGOUSMZKMNRLA-IDDJPJCJNA-N
InChICode InChI=1S/C35H45NO10/c1-14-10-9-11-15(2)35(46)36-22-13-23(37)24-25(32(43)21(8)33(44)26(24)34(22)45)29(40)17(4)12-16(3)28(39)19(6)31(42)20(7)30(41)18(5)27(14)38/h9-14,16,18-20,27-28,30-31,38-39,41-44H,1-8H3,(H,36,46)/b10-9+,15-11-,17-12-/t14-,16-,18-,19-,20-,27-,28+,30+,31-/m0/s1
SMILES C1=C2C(=O)c3c(C1=O)c(c(c(c3O)C)O)C(=O)/C(=C\[C@@H]([C@H]([C@@H]([C@@H]([C@H]([C@@H]([C@H]([C@H]([C@H](/C=C/C=C(\C(=O)N2)/C)C)O)C)O)C)O)C)O)C)/C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Arg L-Asp
Organism
Kingdom Family Species Reference
BacteriaPseudonocardiaceaeAmycolatopsis mediterranei mutant W126 Ref.
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