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 c12c(c(c3c(c1c1c4c(c(c5c1cccc5O)O)C(=O)C[C@@]([C@H]4C(=O)C)(C)O)cccc3O)O)C(=O)C=C([C@H]2C(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces pseudovenezuelae AM-2947 Ref.
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