10,11-dihydro-20-trihydroxy-leukotriene B4

Properties Image MNX_ID MNXM734225 reference biggM:CE5946 formula C20H33O7 global charge -1 mol weight 385.477 InChIKey LSVHZFZMMXHHBS-MNBASXMYSA-M InChI InChI=1S/C20H34O7/c21-17(11-6-2-1-5-9-16-20(25,26)27)12-7-3-4-8-13-18(22)14-10-15-19(23)24/h2-4,6,8,13,17-18,21-22,25-27H,1,5,7,9-12,14-16H2,(H,23,24)/p-1/b4-3+,6-2-,13-8-/t17-,18-/m0/s1 SMILES O=C([O-])CCC[C@@H](O)/C=C\C=C\CC[C@@H](O)C/C=C\CCCCC(O)(O)O MNX internals InChI (mnx) InChI=1/C20H34O7/c21-17(11-6-2-1-5-9-16-20(25,26)27)12-7-3-4-8-13-18(22)14-10-15-19(23)24/h2-4,6,8,13,17-18,21-22,25-27H,1,5,7,9-12,14-16H2,(H,23,24)/b4-3+,6-2-,13-8-/t17-,18-/m0/s1 SMILES (mnx) [CH2:1](/[CH:2]=[CH:6]\[CH2:11][C@@H:17]([CH2:12][CH2:7]/[CH:3]=[CH:4]/[CH:8]=[CH:13]\[C@@H:18]([CH2:14][CH2:10][CH2:15][C:19](=[O:23])[OH:24])[OH:22])[OH:21])[CH2:5][CH2:9][CH2:16][C:20]([OH:25])([OH:26])[OH:27]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 3