Compound Details

 Compound-ID 14018
 Common Name Avermectin A1b
 InChI InChI=1/C48H72O14/c1-25(2)41-28(5)17-18-47(62-41)23-34-20-33(61-47)16-15-27(4)42(59-39-22-37(53-10)44(31(8)57-39)60-38-21-36(52-9)40(49)30(7)56-38)26(3)13-12-14-32-24-55-45-43(54-11)29(6)19-35(46(50)58-34)48(32,45)51/h12-15,17-19,25-26,28,30-31,33-45,49,51H,16,20-24H2,1-11H3/b13-12+,27-15+,32-14+/t26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40-,41+,42-,43+,44-,45+,47+,48+/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(C=CC(C)C(O3)C(C)C)(O4))OC(=O)C(C=C(C)C5(OC))C67(O))
 External Links
 KEGG-COMPOUND-ID C11968
 PUBCHEM-ID 14129


View all entries for compound: Avermectin A1b




© HITS gGmbH