input word = C00018206

Metabolite InformationStructural formula
Name Antibiotic A 39183B
Setomimycin
Formula C34H28O9
Mw 580.17333249
CAS RN 69431-87-4
C_ID C00018206 ,
InChIKey BIEJOJJMQZEKED-UHFFFAOYNA-N
InChICode InChI=1S/C34H28O9/c1-13-11-20(39)27-29(22(13)14(2)35)25(16-7-5-9-18(37)23(16)32(27)41)26-17-8-6-10-19(38)24(17)33(42)28-21(40)12-34(4,43)31(15(3)36)30(26)28/h5-11,22,31,37-38,41-43H,12H2,1-4H3/t22-,31-,34+/m0/s1
SMILES CC(=O)C1C(C)=CC(=O)c2c1c(-c1c3c(c(O)c4c(O)cccc14)C(=O)CC(C)(O)C3C(C)=O)c1cccc(O)c1c2O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces pseudovenezuelae AM-2947 Ref.
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