PE(DiMe(9,5)/DiMe(9,5))

Properties Image MNX_ID MNXM159354 reference hmdb:HMDB0061511 formula C45H78NO10P global charge 0 mol weight 824.09 InChIKey IWZLYZMNVSDNKE-LDLOPFEMSA-N InChI InChI=1S/C45H78NO10P/c1-7-9-19-25-40-35(3)37(5)42(55-40)27-21-15-11-13-17-23-29-44(47)51-33-39(34-53-57(49,50)52-32-31-46)54-45(48)30-24-18-14-12-16-22-28-43-38(6)36(4)41(56-43)26-20-10-8-2/h39H,7-34,46H2,1-6H3,(H,49,50)/t39-/m1/s1 SMILES CCCCCC1=C(C)C(C)=C(CCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCCCC2=C(C)C(C)=C(CCCCC)O2)O1 MNX internals InChI (mnx) InChI=1/C45H78NO10P/c1-7-9-19-25-40-35(3)37(5)42(55-40)27-21-15-11-13-17-23-29-44(47)51-33-39(34-53-57(49,50)52-32-31-46)54-45(48)30-24-18-14-12-16-22-28-43-38(6)36(4)41(56-43)26-20-10-8-2/h39H,7-34,46H2,1-6H3,(H,49,50)/t39-/m1/s1 SMILES (mnx) [CH3:1][CH2:7][CH2:9][CH2:19][CH2:25][C:40]1=[C:35]([CH3:3])[C:37]([CH3:5])=[C:42]([CH2:27][CH2:21][CH2:15][CH2:11][CH2:13][CH2:17][CH2:23][CH2:29][C:44](=[O:47])[O:51][CH2:33][C@H:39]([CH2:34][O:53][P:57]([OH:49])(=[O:50])[O:52][CH2:32][CH2:31][NH2:46])[O:54][C:45]([CH2:30][CH2:24][CH2:18][CH2:14][CH2:12][CH2:16][CH2:22][CH2:28][C:43]2=[C:38]([CH3:6])[C:36]([CH3:4])=[C:41]([CH2:26][CH2:20][CH2:10][CH2:8][CH3:2])[O:56]2)=[O:48])[O:55]1

Parent-child relations graph

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