input word = C00016804

Metabolite InformationStructural formula
Name 7-Hydroxybenanomicinone
Pradimicinone II
Formula C28H23NO12
Mw 565.12202521
CAS RN 146288-38-2
C_ID C00016804 ,
InChIKey SBIJXMUETDVEQB-UHFFFAOYNA-N
InChICode InChI=1S/C28H23NO12/c1-7-4-10-15(22(33)13(7)27(38)29-8(2)28(39)40)16-17(26(37)21(10)32)25(36)19-18(24(16)35)20(31)11-5-9(41-3)6-12(30)14(11)23(19)34/h4-6,8,21,26,30,32-33,35-37H,1-3H3,(H,29,38)(H,39,40)/t8-,21-,26+/m1/s1
SMILES c12c(C(=O)c3c(C1=O)c(c1c(c3O)[C@@H]([C@@H](c3c1c(c(c(c3)C)C(=O)N[C@H](C)C(=O)O)O)O)O)O)c(cc(c2)OC)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
BacteriaThermomonosporaceaeActinomadura verrucosospora subsp. neohibisca E-40 mutant Ref.
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