17-hydroxy-E4-neuroprostane

Properties Image MNX_ID MNXM734392 reference chebi:174980 formula C22H32O5 global charge 0 mol weight 376.493 InChIKey ULILMUUUHYDFOW-HOGCIABESA-N InChI InChI=1S/C22H32O5/c1-2-3-8-11-17(23)14-15-19-18(20(24)16-21(19)25)12-9-6-4-5-7-10-13-22(26)27/h3,5-9,14-15,17-19,21,23,25H,2,4,10-13,16H2,1H3,(H,26,27)/b7-5-,8-3-,9-6-,15-14+ SMILES CC/C=C\CC(O)/C=C/C1C(O)CC(=O)C1C/C=C\C/C=C\CCC(=O)O MNX internals InChI (mnx) InChI=1/C22H32O5/c1-2-3-8-11-17(23)14-15-19-18(20(24)16-21(19)25)12-9-6-4-5-7-10-13-22(26)27/h3,5-9,14-15,17-19,21,23,25H,2,4,10-13,16H2,1H3,(H,26,27)/b7-5-,8-3-,9-6-,15-14+/t17?,18?,19?,21? SMILES (mnx) [CH3:1][CH2:2]/[CH:3]=[CH:8]\[CH2:11][CH:17](/[CH:14]=[CH:15]/[CH:19]1[CH:18]([CH2:12]/[CH:9]=[CH:6]\[CH2:4]/[CH:5]=[CH:7]\[CH2:10][CH2:13][C:22](=[O:26])[OH:27])[C:20](=[O:24])[CH2:16][CH:21]1[OH:25])[OH:23]

Parent-child relations graph

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