1-(11Z,14Z,17Z,20Z,23Z-hexacosapentaenoyl)-2-(13-methyltetradecanoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)

Properties Image MNX_ID MNXM193345 reference slm:000036983 formula C47H82O10P global charge -1 mol weight 838.137 InChIKey ZAHPKWXQXGJCCV-MUTZGYJBSA-M InChI InChI=1S/C47H83O10P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-28-31-34-37-46(50)54-41-45(42-56-58(52,53)55-40-44(49)39-48)57-47(51)38-35-32-29-26-23-24-27-30-33-36-43(2)3/h5-6,8-9,11-12,14-15,17-18,43-45,48-49H,4,7,10,13,16,19-42H2,1-3H3,(H,52,53)/p-1/b6-5-,9-8-,12-11-,15-14-,18-17-/t44-,45+/m0/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)CO)OC(=O)CCCCCCCCCCCC(C)C MNX internals InChI (mnx) InChI=1/C47H83O10P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-28-31-34-37-46(50)54-41-45(42-56-58(52,53)55-40-44(49)39-48)57-47(51)38-35-32-29-26-23-24-27-30-33-36-43(2)3/h5-6,8-9,11-12,14-15,17-18,43-45,48-49H,4,7,10,13,16,19-42H2,1-3H3,(H,52,53)/b6-5-,9-8-,12-11-,15-14-,18-17-/t44-,45+/m0/s1 SMILES (mnx) [CH3:1][CH2:4]/[CH:5]=[CH:6]\[CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19][CH2:20][CH2:21][CH2:22][CH2:25][CH2:28][CH2:31][CH2:34][CH2:37][C:46](=[O:50])[O:54][CH2:41][C@H:45]([CH2:42][O:56][P:58]([OH:52])(=[O:53])[O:55][CH2:40][C@H:44]([CH2:39][OH:48])[OH:49])[O:57][C:47]([CH2:38][CH2:35][CH2:32][CH2:29][CH2:26][CH2:23][CH2:24][CH2:27][CH2:30][CH2:33][CH2:36][CH:43]([CH3:2])[CH3:3])=[O:51]

Parent-child relations graph

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