PC(MonoMe(13,5)/DiMe(11,5))

Properties Image MNX_ID MNXM159297 reference hmdb:HMDB0061454 formula C53H95NO10P global charge 1 mol weight 937.314 InChIKey OCEZARRMPXYRQI-UHFFFAOYSA-O InChI InChI=1S/C53H94NO10P/c1-9-11-27-33-47-41-44(3)49(62-47)34-29-23-19-15-13-14-16-21-25-31-37-52(55)59-42-48(43-61-65(57,58)60-40-39-54(6,7)8)63-53(56)38-32-26-22-18-17-20-24-30-36-51-46(5)45(4)50(64-51)35-28-12-10-2/h41,48H,9-40,42-43H2,1-8H3/p+1 SMILES CCCCCC1=CC(C)=C(CCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCC2=C(C)C(C)=C(CCCCC)O2)O1 MNX internals InChI (mnx) InChI=1/C53H94NO10P/c1-9-11-27-33-47-41-44(3)49(62-47)34-29-23-19-15-13-14-16-21-25-31-37-52(55)59-42-48(43-61-65(57,58)60-40-39-54(6,7)8)63-53(56)38-32-26-22-18-17-20-24-30-36-51-46(5)45(4)50(64-51)35-28-12-10-2/h41,48H,9-40,42-43H2,1-8H3/t48? SMILES (mnx) [CH3:1][CH2:9][CH2:11][CH2:27][CH2:33][C:47]1=[CH:41][C:44]([CH3:3])=[C:49]([CH2:34][CH2:29][CH2:23][CH2:19][CH2:15][CH2:13][CH2:14][CH2:16][CH2:21][CH2:25][CH2:31][CH2:37][C:52](=[O:55])[O:59][CH2:42][CH:48]([CH2:43][O:61][P:65](=[O:57])([O-:58])[O:60][CH2:40][CH2:39][N+:54]([CH3:6])([CH3:7])[CH3:8])[O:63][C:53]([CH2:38][CH2:32][CH2:26][CH2:22][CH2:18][CH2:17][CH2:20][CH2:24][CH2:30][CH2:36][C:51]2=[C:46]([CH3:5])[C:45]([CH3:4])=[C:50]([CH2:35][CH2:28][CH2:12][CH2:10][CH3:2])[O:64]2)=[O:56])[O:62]1

Parent-child relations graph

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