input word = C00018744

Metabolite InformationStructural formula
Name Antibiotic YL 704B3
Leukomycin A6
Turimycin A3
Formula C40H65NO15
Mw 799.43542042
CAS RN 18361-48-3
C_ID C00018744 ,
InChIKey ABTSKZKCMFRYNP-XBUCLSIYNA-N
InChICode InChI=1S/C40H65NO15/c1-11-30(45)54-38-25(5)51-32(21-40(38,7)48)55-35-24(4)52-39(34(47)33(35)41(8)9)56-36-27(17-18-42)19-22(2)28(44)16-14-12-13-15-23(3)50-31(46)20-29(37(36)49-10)53-26(6)43/h12-14,16,18,22-25,27-29,32-39,44,47-48H,11,15,17,19-21H2,1-10H3/b13-12+,16-14+/t22-,23-,24-,25+,27+,28+,29-,32+,33+,34+,35-,36+,37+,38+,39+,40-/m1/s1
SMILES CCC(=O)O[C@H]1C(C)O[C@@H](O[C@@H]2C(C)O[C@@H](O[C@H]3[C@@H](CC=O)C[C@@H](C)[C@@H](O)/C=C/C=C/C[C@@H](C)OC(=O)C[C@@H](OC(C)=O)[C@@H]3OC)C(O)[C@H]2N(C)C)C[C@@]1(C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Secologanin
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces kitasatoensis Ref.
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