input word = C00018747

Metabolite InformationStructural formula
Name Leucomycin A9
Turimycin H2
Formula C37H61NO14
Mw 743.40920567
CAS RN 18361-49-4
C_ID C00018747 ,
InChIKey LOJFCOBMHWVESZ-XIMXWXHBNA-N
InChICode InChI=1S/C37H61NO14/c1-20-17-25(15-16-39)33(34(46-9)27(42)18-28(43)47-21(2)13-11-10-12-14-26(20)41)52-36-31(44)30(38(7)8)32(22(3)49-36)51-29-19-37(6,45)35(23(4)48-29)50-24(5)40/h10-12,14,16,20-23,25-27,29-36,41-42,44-45H,13,15,17-19H2,1-9H3/b11-10+,14-12+/t20-,21-,22-,23+,25+,26+,27-,29+,30+,31+,32-,33+,34+,35+,36+,37-/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]1O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Secologanin
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces kitasatoensis Ref.
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