input word = C00018160

Metabolite InformationStructural formula
Name Saframycin D
Formula C28H31N3O9
Mw 553.20602961
CAS RN 66082-30-2
C_ID C00018160 ,
InChIKey JRGSNFZUTBSLSG-NCUHWMGJNA-N
InChICode InChI=1S/C28H31N3O9/c1-10-21(33)13-7-14-20-18-19(22(34)11(2)27(40-6)25(18)37)23(35)16(30(20)4)9-31(14)15(8-29-28(38)12(3)32)17(13)24(36)26(10)39-5/h14-16,20,34,37H,7-9H2,1-6H3,(H,29,38)/t14-,15-,16+,20-/m0/s1
SMILES COC1=C(C)C(=O)C2=C(C1=O)[C@H](CNC(=O)C(C)=O)N1C[C@@H]3C(=O)c4c(O)c(C)c(OC)c(O)c4[C@H]([C@@H]1C2)N3C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Arg L-Asp
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces lavendulae No. 314 Ref.
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OrganismStreptomyces lavendulae No. 314
ReferenceArai,J. Antibiotics,30,(1977),1015