12-hydroxyeicosatetraenoate

Properties Image MNX_ID MNXM1368130 reference biggM:CE0347 formula C20H31O3 global charge -1 mol weight 319.465 InChIKey ZNHVWPKMFKADKW-FYMOKONMSA-M InChI InChI=1S/C20H32O3/c1-2-3-4-5-10-13-16-19(21)17-14-11-8-6-7-9-12-15-18-20(22)23/h7-11,13-14,17,19,21H,2-6,12,15-16,18H2,1H3,(H,22,23)/p-1/b9-7+,11-8-,13-10-,17-14- SMILES CCCCC/C=C\CC(O)/C=C\C=C/C/C=C/CCCC(=O)[O-] MNX internals InChI (mnx) InChI=1/C20H32O3/c1-2-3-4-5-10-13-16-19(21)17-14-11-8-6-7-9-12-15-18-20(22)23/h7-11,13-14,17,19,21H,2-6,12,15-16,18H2,1H3,(H,22,23)/b9-7+,11-8-,13-10-,17-14-/t19? SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH2:4][CH2:5]/[CH:10]=[CH:13]\[CH2:16][CH:19](/[CH:17]=[CH:14]\[CH:11]=[CH:8]/[CH2:6]/[CH:7]=[CH:9]/[CH2:12][CH2:15][CH2:18][C:20](=[O:22])[OH:23])[OH:21]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 7 in models (compartimentalized) 8