methyl 10,12-dihydroperoxy-8E,13E,15Z-octadecatrienoate

Properties Image MNX_ID MNXM26554 reference lipidmapsM:LMFA01040047 formula C19H32O6 global charge 0 mol weight 356.459 InChIKey BGOZUGHQDFEPNG-VFWXGKICSA-N InChI InChI=1S/C19H32O6/c1-3-4-5-10-13-17(24-21)16-18(25-22)14-11-8-6-7-9-12-15-19(20)23-2/h4-5,10-11,13-14,17-18,21-22H,3,6-9,12,15-16H2,1-2H3/b5-4-,13-10+,14-11+ SMILES CC/C=C\C=C\C(CC(/C=C/CCCCCCC(=O)OC)OO)OO MNX internals InChI (mnx) InChI=1/C19H32O6/c1-3-4-5-10-13-17(24-21)16-18(25-22)14-11-8-6-7-9-12-15-19(20)23-2/h4-5,10-11,13-14,17-18,21-22H,3,6-9,12,15-16H2,1-2H3/b5-4-,13-10+,14-11+/t17?,18? SMILES (mnx) [CH3:1][CH2:3]/[CH:4]=[CH:5]\[CH:10]=[CH:13]\[CH:17]([CH2:16][CH:18](/[CH:14]=[CH:11]/[CH2:8][CH2:6][CH2:7][CH2:9][CH2:12][CH2:15][C:19](=[O:20])[O:23][CH3:2])[O:25][OH:22])[O:24][OH:21]

Parent-child relations graph

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