Cardiolipin (20:4(5Z,8Z,11Z,14Z)/18:2(9Z,12Z)/22:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Properties Image MNX_ID MNXM881157 reference slm:000572136 formula C89H138O17P2 global charge -2 mol weight 1542.014 InChIKey XMXZCIQUZXNDHK-OTMZRNTCSA-L InChI InChI=1S/C89H140O17P2/c1-5-9-13-17-21-25-29-33-37-40-41-44-48-52-56-60-64-68-72-76-89(94)106-85(80-100-87(92)74-70-66-62-58-54-50-47-43-39-35-31-27-23-19-15-11-7-3)82-104-108(97,98)102-78-83(90)77-101-107(95,96)103-81-84(105-88(93)75-71-67-63-59-55-51-45-36-32-28-24-20-16-12-8-4)79-99-86(91)73-69-65-61-57-53-49-46-42-38-34-30-26-22-18-14-10-6-2/h9,11,13,15,21-28,33-39,41,44-47,49-50,52,56-58,61-62,64,68,83-85,90H,5-8,10,12,14,16-20,29-32,40,42-43,48,51,53-55,59-60,63,65-67,69-82H2,1-4H3,(H,95,96)(H,97,98)/p-2/b13-9-,15-11-,25-21-,26-22-,27-23-,28-24-,37-33-,38-34-,39-35-,44-41-,45-36-,49-46-,50-47-,56-52-,61-57-,62-58-,68-64-/t83?,84-,85-/m1/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)COP(=O)([O-])OCC(O)COP(=O)([O-])OC[C@@H](COC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC MNX internals InChI (mnx) InChI=1/C89H140O17P2/c1-5-9-13-17-21-25-29-33-37-40-41-44-48-52-56-60-64-68-72-76-89(94)106-85(80-100-87(92)74-70-66-62-58-54-50-47-43-39-35-31-27-23-19-15-11-7-3)82-104-108(97,98)102-78-83(90)77-101-107(95,96)103-81-84(105-88(93)75-71-67-63-59-55-51-45-36-32-28-24-20-16-12-8-4)79-99-86(91)73-69-65-61-57-53-49-46-42-38-34-30-26-22-18-14-10-6-2/h9,11,13,15,21-28,33-39,41,44-47,49-50,52,56-58,61-62,64,68,83-85,90H,5-8,10,12,14,16-20,29-32,40,42-43,48,51,53-55,59-60,63,65-67,69-82H2,1-4H3,(H,95,96)(H,97,98)/b13-9-,15-11-,25-21-,26-22-,27-23-,28-24-,37-33-,38-34-,39-35-,44-41-,45-36-,49-46-,50-47-,56-52-,61-57-,62-58-,68-64-/t83?,84-,85-/m1/s1 SMILES (mnx) [CH3:1][CH2:5]/[CH:9]=[CH:13]\[CH2:17]/[CH:21]=[CH:25]\[CH2:29]/[CH:33]=[CH:37]\[CH2:40]/[CH:41]=[CH:44]\[CH2:48]/[CH:52]=[CH:56]\[CH2:60]/[CH:64]=[CH:68]\[CH2:72][CH2:76][C:89](=[O:94])[O:106][C@H:85]([CH2:80][O:100][C:87]([CH2:74][CH2:70][CH2:66]/[CH:62]=[CH:58]\[CH2:54]/[CH:50]=[CH:47]\[CH2:43]/[CH:39]=[CH:35]\[CH2:31]/[CH:27]=[CH:23]\[CH2:19]/[CH:15]=[CH:11]\[CH2:7][CH3:3])=[O:92])[CH2:82][O:104][P:108]([OH:97])(=[O:98])[O:102][CH2:78][CH:83]([CH2:77][O:101][P:107]([OH:95])(=[O:96])[O:103][CH2:81][C@@H:84]([CH2:79][O:99][C:86]([CH2:73][CH2:69][CH2:65]/[CH:61]=[CH:57]\[CH2:53]/[CH:49]=[CH:46]\[CH2:42]/[CH:38]=[CH:34]\[CH2:30]/[CH:26]=[CH:22]\[CH2:18][CH2:14][CH2:10][CH2:6][CH3:2])=[O:91])[O:105][C:88]([CH2:75][CH2:71][CH2:67][CH2:63][CH2:59][CH2:55][CH2:51]/[CH:45]=[CH:36]\[CH2:32]/[CH:28]=[CH:24]\[CH2:20][CH2:16][CH2:12][CH2:8][CH3:4])=[O:93])[OH:90]

Parent-child relations graph

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