input word = C00018710

Metabolite InformationStructural formula
Name Leucomycin A1
3-Deacetyljosamycin
3-O-Deacetyljosamycin
Kitasamycin A1
Leucomycin V 4-isovalerate
Turimycin H5
Formula C40H67NO14
Mw 785.45615586
CAS RN 16846-34-7
C_ID C00018710 ,
InChIKey IEMDOFXTVAPVLX-MGCPBOGKNA-N
InChICode InChI=1S/C40H67NO14/c1-22(2)18-30(45)53-38-26(6)51-32(21-40(38,7)48)54-35-25(5)52-39(34(47)33(35)41(8)9)55-36-27(16-17-42)19-23(3)28(43)15-13-11-12-14-24(4)50-31(46)20-29(44)37(36)49-10/h11-13,15,17,22-29,32-39,43-44,47-48H,14,16,18-21H2,1-10H3/b12-11+,15-13+/t23-,24-,25+,26-,27+,28+,29-,32+,33+,34-,35-,36+,37+,38+,39+,40-/m1/s1
SMILES [C@@H]1(C[C@H]([C@H](/C=C/C=C/C[C@H](OC(=O)C[C@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)C)O[C@@H]1O[C@@H]([C@@H]([C@](C1)(C)O)OC(=O)CC(C)C)C)N(C)C)O)OC)O)C)O)C)CC=O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Secologanin
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces kitasatoensis Ref.
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OrganismStreptomyces kitasatoensis
ReferenceAbe,J. Antibiotics Series A,16,(1963),214