5-Oxoavermectin ''2a'' aglycone

Properties Image Occurences in reactions MNX_ID MNXM6936 #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0 formula C34H48O9 charge 0 mass 600.32983 reference keggC:C11970 InChIKey AWFYDDCOWUMYCB-ILCSDPHRSA-N InChI InChI=1S/C34H48O9/c1-7-18(2)30-22(6)27(35)16-33(43-30)15-25-14-24(42-33)12-11-20(4)28(36)19(3)9-8-10-23-17-40-31-29(37)21(5)13-26(32(38)41-25)34(23,31)39/h8-11,13,18-19,22,24-28,30-31,35-36,39H,7,12,14-17H2,1-6H3/b9-8+,20-11+,23-10+/t18?,19-,22-,24+,25-,26-,27-,28-,30+,31+,33-,34+/m0/s1 SMILES CCC(C)[C@H]1O[C@@]2(C[C@@H]3C[C@@H](C/C=C(\C)[C@@H](O)[C@@H](C)/C=C/C=C4\CO[C@@H]5C(=O)C(C)=C[C@@H](C(=O)O3)[C@]45O)O2)C[C@H](O)[C@@H]1C

Parent-child relations graph

Deprecated MNXref IDs graph