**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

12-hydroperoxyeicosatetraenoate glyceryl ester

Properties Image MNX_ID MNXM164054 reference biggM:CE5700 formula C23H38O6 global charge 0 mol weight 410.551 InChIKey DRKQAMJEQFTELM-NRFANRHFSA-N InChI InChI=1S/C23H38O6/c1-2-3-4-5-10-13-16-21(29-27)17-14-11-8-6-7-9-12-15-18-23(26)28-22(19-24)20-25/h7-11,13-14,17,21-22,24-25,27H,2-6,12,15-16,18-20H2,1H3/t21-/m0/s1 SMILES CCCCCC=CC[C@@H](C=CC=CCC=CCCCC(=O)OC(CO)CO)OO MNX internals InChI (mnx) InChI=1/C23H38O6/c1-2-3-4-5-10-13-16-21(29-27)17-14-11-8-6-7-9-12-15-18-23(26)28-22(19-24)20-25/h7-11,13-14,17,21-22,24-25,27H,2-6,12,15-16,18-20H2,1H3/b9-7?,11-8?,13-10?,17-14?/t21-/m0/s1 SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH:10]=[CH:13][CH2:16][C@@H:21]([CH:17]=[CH:14][CH:11]=[CH:8][CH2:6][CH:7]=[CH:9][CH2:12][CH2:15][CH2:18][C:23](=[O:26])[O:28][CH:22]([CH2:19][OH:24])[CH2:20][OH:25])[O:29][OH:27]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 2

Similar chemical compounds in external resources

Identifier	Description
bigg.metabolite:CE5700 biggM:CE5700 vmhM:g_2arachd12ooh vmhM:g_2arachd12ooh vmhmetabolite:g_2arachd12ooh vmhmetabolite:g_2arachd12ooh DRKQAMJEQFTELM-NRFANRHFSA-N	12-hydroperoxyeicosatetraenoate glyceryl ester
vmhM:CE5700 vmhM:CE5700 biggM:M_CE5700 vmhM:M_g_2arachd12ooh	secondary/obsolete/fantasy identifier