PT(20:1(9Z)/20:4(5Z,8Z,11Z,14Z))

Properties Image MNX_ID MNXM1130909 reference lipidmapsM:LMGP00000067 formula C47H82NO10P global charge 0 mol weight 852.144 InChIKey AOPDJXXVYGUFIR-SCRBSXKESA-N InChI InChI=1S/C47H82NO10P/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-44(49)55-40-43(41-56-59(53,54)58-42(3)46(48)47(51)52)57-45(50)39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h13,15,19,21-22,24-25,27,31,33,42-43,46H,4-12,14,16-18,20,23,26,28-30,32,34-41,48H2,1-3H3,(H,51,52)(H,53,54)/b15-13-,21-19-,24-22-,27-25-,33-31-/t42-,43-,46+/m1/s1 SMILES CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCCCCCC)COP(=O)(O)O[C@H](C)[C@H](N)C(=O)O MNX internals InChI (mnx) InChI=1/C47H82NO10P/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-44(49)55-40-43(41-56-59(53,54)58-42(3)46(48)47(51)52)57-45(50)39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h13,15,19,21-22,24-25,27,31,33,42-43,46H,4-12,14,16-18,20,23,26,28-30,32,34-41,48H2,1-3H3,(H,51,52)(H,53,54)/b15-13-,21-19-,24-22-,27-25-,33-31-/t42-,43-,46+/m1/s1 SMILES (mnx) [CH3:1][CH2:4][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:20]/[CH:22]=[CH:24]\[CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][C:44](=[O:49])[O:55][CH2:40][C@H:43]([CH2:41][O:56][P:59]([OH:53])(=[O:54])[O:58][C@H:42]([CH3:3])[C@@H:46]([C:47](=[O:51])[OH:52])[NH2:48])[O:57][C:45]([CH2:39][CH2:37][CH2:35]/[CH:33]=[CH:31]\[CH2:29]/[CH:27]=[CH:25]\[CH2:23]/[CH:21]=[CH:19]\[CH2:17]/[CH:15]=[CH:13]\[CH2:11][CH2:9][CH2:7][CH2:5][CH3:2])=[O:50]

Parent-child relations graph

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