CL(i-12:0/i-24:0/i-12:0/i-19:0)

Properties Image MNX_ID MNXM1110507 reference hmdb:HMDB0089225 formula C76H148O17P2 global charge 0 mol weight 1395.951 InChIKey LOMHDYPNPKEJBX-PIDZFBOHSA-N InChI InChI=1S/C76H148O17P2/c1-66(2)52-44-36-28-24-20-16-13-11-9-10-12-14-18-22-26-30-42-50-58-75(80)92-71(62-86-73(78)56-48-40-34-32-38-46-54-68(5)6)64-90-94(82,83)88-60-70(77)61-89-95(84,85)91-65-72(63-87-74(79)57-49-41-35-33-39-47-55-69(7)8)93-76(81)59-51-43-31-27-23-19-15-17-21-25-29-37-45-53-67(3)4/h66-72,77H,9-65H2,1-8H3,(H,82,83)(H,84,85)/t70-,71+,72+/m0/s1 SMILES CC(C)CCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC(C)C)COP(=O)(O)OC[C@H](O)COP(=O)(O)OC[C@@H](COC(=O)CCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCC(C)C MNX internals InChI (mnx) InChI=1/C76H148O17P2/c1-66(2)52-44-36-28-24-20-16-13-11-9-10-12-14-18-22-26-30-42-50-58-75(80)92-71(62-86-73(78)56-48-40-34-32-38-46-54-68(5)6)64-90-94(82,83)88-60-70(77)61-89-95(84,85)91-65-72(63-87-74(79)57-49-41-35-33-39-47-55-69(7)8)93-76(81)59-51-43-31-27-23-19-15-17-21-25-29-37-45-53-67(3)4/h66-72,77H,9-65H2,1-8H3,(H,82,83)(H,84,85)/t70-,71+,72+/m0/s1 SMILES (mnx) [CH3:1][CH:66]([CH3:2])[CH2:52][CH2:44][CH2:36][CH2:28][CH2:24][CH2:20][CH2:16][CH2:13][CH2:11][CH2:9][CH2:10][CH2:12][CH2:14][CH2:18][CH2:22][CH2:26][CH2:30][CH2:42][CH2:50][CH2:58][C:75](=[O:80])[O:92][C@H:71]([CH2:62][O:86][C:73]([CH2:56][CH2:48][CH2:40][CH2:34][CH2:32][CH2:38][CH2:46][CH2:54][CH:68]([CH3:5])[CH3:6])=[O:78])[CH2:64][O:90][P:94]([OH:82])(=[O:83])[O:88][CH2:60][C@@H:70]([CH2:61][O:89][P:95]([OH:84])(=[O:85])[O:91][CH2:65][C@@H:72]([CH2:63][O:87][C:74]([CH2:57][CH2:49][CH2:41][CH2:35][CH2:33][CH2:39][CH2:47][CH2:55][CH:69]([CH3:7])[CH3:8])=[O:79])[O:93][C:76]([CH2:59][CH2:51][CH2:43][CH2:31][CH2:27][CH2:23][CH2:19][CH2:15][CH2:17][CH2:21][CH2:25][CH2:29][CH2:37][CH2:45][CH2:53][CH:67]([CH3:3])[CH3:4])=[O:81])[OH:77]

Parent-child relations graph

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