methyl 13,15-epidioxy-16-hydroperoxy-9,11-octadecadienoate

Properties Image MNX_ID MNXM28908 reference lipidmapsM:LMFA01040041 formula C19H32O6 global charge 0 mol weight 356.459 InChIKey ZXMQUTOSCPQVII-PTSVWTKZSA-N InChI InChI=1S/C19H32O6/c1-3-17(23-21)18-15-16(24-25-18)13-11-9-7-5-4-6-8-10-12-14-19(20)22-2/h7,9,11,13,16-18,21H,3-6,8,10,12,14-15H2,1-2H3/b9-7+,13-11+ SMILES CCC(OO)C1CC(/C=C/C=C/CCCCCCCC(=O)OC)OO1 MNX internals InChI (mnx) InChI=1/C19H32O6/c1-3-17(23-21)18-15-16(24-25-18)13-11-9-7-5-4-6-8-10-12-14-19(20)22-2/h7,9,11,13,16-18,21H,3-6,8,10,12,14-15H2,1-2H3/b9-7+,13-11+/t16?,17?,18? SMILES (mnx) [CH3:1][CH2:3][CH:17]([CH:18]1[CH2:15][CH:16](/[CH:13]=[CH:11]/[CH:9]=[CH:7]/[CH2:5][CH2:4][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][C:19](=[O:20])[O:22][CH3:2])[O:24][O:25]1)[O:23][OH:21]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0