input word = C00018746

Metabolite InformationStructural formula
Name Leukomycin A8
Turimycin A2
Formula C39H63NO15
Mw 785.41977035
CAS RN 18361-50-7
C_ID C00018746 ,
InChIKey ZGKBDJKFINKSNH-GTDCIZSNNA-N
InChICode InChI=1S/C39H63NO15/c1-21-18-27(16-17-41)35(36(48-10)29(52-25(5)42)19-30(45)49-22(2)14-12-11-13-15-28(21)44)55-38-33(46)32(40(8)9)34(23(3)51-38)54-31-20-39(7,47)37(24(4)50-31)53-26(6)43/h11-13,15,17,21-24,27-29,31-38,44,46-47H,14,16,18-20H2,1-10H3/b12-11+,15-13+/t21-,22-,23+,24+,27+,28+,29-,31+,32+,33-,34-,35+,36+,37+,38+,39-/m1/s1
SMILES CO[C@@H]1[C@@H](O[C@@H]2OC(C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](OC(C)=O)C(C)O3)[C@H](N(C)C)C2O)[C@@H](CC=O)C[C@@H](C)[C@@H](O)/C=C/C=C/C[C@@H](C)OC(=O)C[C@H]1OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Secologanin
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces kitasatoensis Ref.
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