Compound Details

 Compound-ID 14026
 Common Name Avermectin A2a
 InChI InChI=1/C49H76O15/c1-12-25(2)43-29(6)36(50)23-48(64-43)22-34-19-33(63-48)17-16-27(4)42(61-40-21-38(55-10)45(31(8)59-40)62-39-20-37(54-9)41(51)30(7)58-39)26(3)14-13-15-32-24-57-46-44(56-11)28(5)18-35(47(52)60-34)49(32,46)53/h13-16,18,25-26,29-31,33-46,50-51,53H,12,17,19-24H2,1-11H3/b14-13+,27-16+,32-15+/t25-,26-,29-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40-,41-,42-,43+,44+,45-,46+,48-,49+/m0/s1
 SMILES [H]C57(OCC6=CC=CC(C)C(OC2CC(OC)C(OC1CC(OC)C(O)C(C)O1)C(C)O2)C(C)=CCC4CC(CC3(CC(O)C(C)C(O3)C(C)CC)(O4))OC(=O)C(C=C(C)C5(OC))C67(O))
 External Links
 KEGG-COMPOUND-ID C11976
 PUBCHEM-ID 14137


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