DG(15:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]

Properties Image MNX_ID MNXM104432 reference lipidmapsM:LMGL02010473 formula C40H64O5 global charge 0 mol weight 624.947 InChIKey PBTFNQHSIYCLII-WDTXVJSOSA-N InChI InChI=1S/C40H64O5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-40(43)45-38(36-41)37-44-39(42)34-32-30-28-26-24-16-14-12-10-8-6-4-2/h5,7,11-14,17-18,20-21,23,25,29,31,38,41H,3-4,6,8-10,15-16,19,22,24,26-28,30,32-37H2,1-2H3/b7-5-,13-11-,14-12-,18-17-,21-20-,25-23-,31-29-/t38-/m0/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@@H](CO)COC(=O)CCCCCCC/C=C\CCCCC MNX internals InChI (mnx) InChI=1/C40H64O5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-40(43)45-38(36-41)37-44-39(42)34-32-30-28-26-24-16-14-12-10-8-6-4-2/h5,7,11-14,17-18,20-21,23,25,29,31,38,41H,3-4,6,8-10,15-16,19,22,24,26-28,30,32-37H2,1-2H3/b7-5-,13-11-,14-12-,18-17-,21-20-,25-23-,31-29-/t38-/m0/s1 SMILES (mnx) [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22]/[CH:23]=[CH:25]\[CH2:27]/[CH:29]=[CH:31]\[CH2:33][CH2:35][C:40](=[O:43])[O:45][C@@H:38]([CH2:36][OH:41])[CH2:37][O:44][C:39]([CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:42]

Parent-child relations graph

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