PC(DiMe(11,3)/DiMe(11,3))

Properties Image MNX_ID MNXM159233 reference hmdb:HMDB0061390 formula C48H85NO10P global charge 1 mol weight 867.179 InChIKey DQXMMQRBHZWYPT-UHFFFAOYSA-O InChI InChI=1S/C48H84NO10P/c1-10-28-43-38(3)40(5)45(58-43)30-24-20-16-12-14-18-22-26-32-47(50)54-36-42(37-56-60(52,53)55-35-34-49(7,8)9)57-48(51)33-27-23-19-15-13-17-21-25-31-46-41(6)39(4)44(59-46)29-11-2/h42H,10-37H2,1-9H3/p+1 SMILES CCCC1=C(C)C(C)=C(CCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCC2=C(C)C(C)=C(CCC)O2)O1 MNX internals InChI (mnx) InChI=1/C48H84NO10P/c1-10-28-43-38(3)40(5)45(58-43)30-24-20-16-12-14-18-22-26-32-47(50)54-36-42(37-56-60(52,53)55-35-34-49(7,8)9)57-48(51)33-27-23-19-15-13-17-21-25-31-46-41(6)39(4)44(59-46)29-11-2/h42H,10-37H2,1-9H3/t42? SMILES (mnx) [CH3:1][CH2:10][CH2:28][C:43]1=[C:38]([CH3:3])[C:40]([CH3:5])=[C:45]([CH2:30][CH2:24][CH2:20][CH2:16][CH2:12][CH2:14][CH2:18][CH2:22][CH2:26][CH2:32][C:47](=[O:50])[O:54][CH2:36][CH:42]([CH2:37][O:56][P:60](=[O:52])([O-:53])[O:55][CH2:35][CH2:34][N+:49]([CH3:7])([CH3:8])[CH3:9])[O:57][C:48]([CH2:33][CH2:27][CH2:23][CH2:19][CH2:15][CH2:13][CH2:17][CH2:21][CH2:25][CH2:31][C:46]2=[C:41]([CH3:6])[C:39]([CH3:4])=[C:44]([CH2:29][CH2:11][CH3:2])[O:59]2)=[O:51])[O:58]1

Parent-child relations graph

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