2-C22:0-DCA-LPA

Properties Image MNX_ID MNXM114585 reference metacycM:CPD-14776 formula C25H46O9P global charge -3 mol weight 521.608 InChIKey POHJJGKCTRJDSU-HSZRJFAPSA-K InChI InChI=1S/C25H49O9P/c26-21-23(22-33-35(30,31)32)34-25(29)20-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19-24(27)28/h23,26H,1-22H2,(H,27,28)(H2,30,31,32)/p-3/t23-/m1/s1 SMILES O=C([O-])CCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](CO)COP(=O)([O-])[O-] MNX internals InChI (mnx) InChI=1/C25H49O9P/c26-21-23(22-33-35(30,31)32)34-25(29)20-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19-24(27)28/h23,26H,1-22H2,(H,27,28)(H2,30,31,32)/t23-/m1/s1 SMILES (mnx) [CH2:1]([CH2:2][CH2:4][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:20][C:25](=[O:29])[O:34][C@H:23]([CH2:21][OH:26])[CH2:22][O:33][P:35]([OH:30])([OH:31])=[O:32])[CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][C:24](=[O:27])[OH:28]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0