CL(i-12:0/i-22:0/a-13:0/i-22:0)[rac]

Properties Image MNX_ID MNXM1108661 reference hmdb:HMDB0088940 formula C78H152O17P2 global charge 0 mol weight 1424.005 InChIKey OVKGXCHGANKMQU-DMTOUAIBSA-N InChI InChI=1S/C78H152O17P2/c1-9-71(8)57-49-41-35-37-43-51-59-76(81)89-65-74(95-78(83)61-53-45-33-29-25-21-17-13-11-15-19-23-27-31-39-47-55-69(4)5)67-93-97(86,87)91-63-72(79)62-90-96(84,85)92-66-73(64-88-75(80)58-50-42-36-34-40-48-56-70(6)7)94-77(82)60-52-44-32-28-24-20-16-12-10-14-18-22-26-30-38-46-54-68(2)3/h68-74,79H,9-67H2,1-8H3,(H,84,85)(H,86,87)/t71?,72-,73+,74+/m0/s1 SMILES CCC(C)CCCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@@H](O)COP(=O)(O)OC[C@@H](COC(=O)CCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCCCC(C)C MNX internals InChI (mnx) InChI=1/C78H152O17P2/c1-9-71(8)57-49-41-35-37-43-51-59-76(81)89-65-74(95-78(83)61-53-45-33-29-25-21-17-13-11-15-19-23-27-31-39-47-55-69(4)5)67-93-97(86,87)91-63-72(79)62-90-96(84,85)92-66-73(64-88-75(80)58-50-42-36-34-40-48-56-70(6)7)94-77(82)60-52-44-32-28-24-20-16-12-10-14-18-22-26-30-38-46-54-68(2)3/h68-74,79H,9-67H2,1-8H3,(H,84,85)(H,86,87)/t71?,72-,73+,74+/m0/s1 SMILES (mnx) [CH3:1][CH2:9][CH:71]([CH3:8])[CH2:57][CH2:49][CH2:41][CH2:35][CH2:37][CH2:43][CH2:51][CH2:59][C:76](=[O:81])[O:89][CH2:65][C@H:74]([CH2:67][O:93][P:97]([OH:86])(=[O:87])[O:91][CH2:63][C@H:72]([CH2:62][O:90][P:96]([OH:84])(=[O:85])[O:92][CH2:66][C@@H:73]([CH2:64][O:88][C:75]([CH2:58][CH2:50][CH2:42][CH2:36][CH2:34][CH2:40][CH2:48][CH2:56][CH:70]([CH3:6])[CH3:7])=[O:80])[O:94][C:77]([CH2:60][CH2:52][CH2:44][CH2:32][CH2:28][CH2:24][CH2:20][CH2:16][CH2:12][CH2:10][CH2:14][CH2:18][CH2:22][CH2:26][CH2:30][CH2:38][CH2:46][CH2:54][CH:68]([CH3:2])[CH3:3])=[O:82])[OH:79])[O:95][C:78]([CH2:61][CH2:53][CH2:45][CH2:33][CH2:29][CH2:25][CH2:21][CH2:17][CH2:13][CH2:11][CH2:15][CH2:19][CH2:23][CH2:27][CH2:31][CH2:39][CH2:47][CH2:55][CH:69]([CH3:4])[CH3:5])=[O:83]

Parent-child relations graph

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