input word = C00018161

Metabolite InformationStructural formula
Name Saframycin E
Formula C28H33N3O9
Mw 555.22167968
CAS RN 66082-31-3
C_ID C00018161 ,
InChIKey APNOKSAARSYAPV-UHFFFAOYNA-N
InChICode InChI=1S/C28H33N3O9/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/h14-16,20,23,34-35,37H,7-9H2,1-6H3,(H,29,38)/t14-,15-,16-,20+,23+/m0/s1
SMILES COC1=C(C)C(=O)C2=C(C1=O)C(CNC(=O)C(C)=O)N1CC3C(O)c4c(O)c(C)c(OC)c(O)c4C(C1C2)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