1-(8Z,11Z,14Z-eicosatrienoyl)-3-(13Z,16Z-docosadienoyl)-sn-glycerol

Properties Image MNX_ID MNXM124633 reference slm:000125034 formula C45H78O5 global charge 0 mol weight 699.114 InChIKey PRCDHGNUOILRSJ-QUPMYNEGSA-N InChI InChI=1S/C45H78O5/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-40-45(48)50-42-43(46)41-49-44(47)39-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,25,27,43,46H,3-10,15-16,21-24,26,28-42H2,1-2H3/b13-11-,14-12-,19-17-,20-18-,27-25-/t43-/m1/s1 SMILES CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC[C@@H](O)COC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC MNX internals InChI (mnx) InChI=1/C45H78O5/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-40-45(48)50-42-43(46)41-49-44(47)39-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,25,27,43,46H,3-10,15-16,21-24,26,28-42H2,1-2H3/b13-11-,14-12-,19-17-,20-18-,27-25-/t43-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][C:45](=[O:48])[O:50][CH2:42][C@@H:43]([CH2:41][O:49][C:44]([CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29]/[CH:27]=[CH:25]\[CH2:23]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:47])[OH:46]

Parent-child relations graph

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