Tetranor 12-HETE

Properties Image MNX_ID MNXM161522 reference chebi:89569 formula C16H26O3 global charge 0 mol weight 266.381 InChIKey KBOVKDIBOBQLRS-ONCCEEIJSA-N InChI InChI=1S/C16H26O3/c1-2-3-4-5-6-9-12-15(17)13-10-7-8-11-14-16(18)19/h6-10,13,15,17H,2-5,11-12,14H2,1H3,(H,18,19)/b8-7-,9-6-,13-10+/t15-/m0/s1 SMILES CCCCC/C=C\C[C@H](O)/C=C/C=C\CCC(=O)O MNX internals InChI (mnx) InChI=1/C16H26O3/c1-2-3-4-5-6-9-12-15(17)13-10-7-8-11-14-16(18)19/h6-10,13,15,17H,2-5,11-12,14H2,1H3,(H,18,19)/b8-7-,9-6-,13-10+/t15-/m0/s1 SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH2:4][CH2:5]/[CH:6]=[CH:9]\[CH2:12][C@@H:15](/[CH:13]=[CH:10]/[CH:7]=[CH:8]\[CH2:11][CH2:14][C:16](=[O:18])[OH:19])[OH:17]

Parent-child relations graph

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