6,8a-seco-6,8a-deoxy-5-oxoavermectin "2a" aglycone

Properties Image Occurences in reactions MNX_ID MNXM6945 #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 0 formula C34H50O8 charge 0 mass 586.35057 reference chebi:138851 InChIKey QCSFFKFCYQTXGW-ZGLBEODDSA-N InChI InChI=1S/C34H50O8/c1-8-19(2)31-24(7)29(36)17-33(42-31)16-26-15-25(41-33)13-12-21(4)30(37)20(3)10-9-11-23(6)34(39)18-28(35)22(5)14-27(34)32(38)40-26/h9-12,14,19-20,24-27,29-31,36-37,39H,8,13,15-18H2,1-7H3/b10-9+,21-12+,23-11+/t19?,20-,24-,25+,26-,27-,29-,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=C(\C)[C@]4(O)CC(=O)C(C)=C[C@H]4C(=O)O3)O2)C[C@H](O)[C@@H]1C

Parent-child relations graph

Deprecated MNXref IDs graph