input word = C00017669

Metabolite InformationStructural formula
Name Trienomycin E
Formula C35H50N2O7
Mw 610.36180197
CAS RN 107140-29-4
C_ID C00017669 ,
InChIKey JJBUXIPSVLPJSA-PBTLBFCBNA-N
InChICode InChI=1S/C35H50N2O7/c1-23(2)17-18-32(39)36-26(5)35(42)44-31-16-11-9-7-8-10-15-30(43-6)22-33(40)37-28-19-27(20-29(38)21-28)14-12-13-24(3)34(41)25(31)4/h7-11,13,15,19-21,23,25-26,30-31,34,38,41H,12,14,16-18,22H2,1-6H3,(H,36,39)(H,37,40)/b8-7+,11-9-,15-10+,24-13+/t25-,26-,30+,31+,34-/m0/s1
SMILES N1c2cc(cc(CC/C=C(/[C@@H]([C@H]([C@@H](C/C=C\C=C\C=C\[C@H](CC1=O)OC)OC(=O)[C@H](C)NC(=O)CCC(C)C)C)O)\C)c2)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. No.82-85 Ref.
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OrganismStreptomyces sp. No.82-85
ReferenceNomoto,J.Antibiotics,42,(1989),479