input word = C00018816

Metabolite InformationStructural formula
Name Kidamycin
NSC 143094
NSC 295565
Rubiflavin B
Formula C39H48N2O9
Mw 688.33598115
CAS RN 11072-82-5
C_ID C00018816 ,
InChIKey MFTJRTUKCOVIMD-GZTJUZNONA-N
InChICode InChI=1S/C39H48N2O9/c1-11-17(2)26-15-25(42)29-18(3)12-23-31(37(29)50-26)36(46)32-30(35(23)45)21(27-14-24(40(7)8)33(43)19(4)48-27)13-22(34(32)44)28-16-39(6,41(9)10)38(47)20(5)49-28/h11-13,15,19-20,24,27-28,33,38,43-44,47H,14,16H2,1-10H3/b17-11+/t19-,20+,24+,27-,28+,33+,38+,39-/m1/s1
SMILES c1(cc(c2c(c1O)C(=O)c1c(C2=O)cc(c2c1oc(cc2=O)/C(=C/C)/C)C)[C@H]1C[C@@H]([C@H]([C@H](O1)C)O)N(C)C)[C@H]1O[C@H]([C@@H]([C@](C1)(C)N(C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces phaeoverticillatus var. takatsukiensis No.2-89 Ref.
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