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CL(1'-[16:0/18:2(9Z,12Z)],3'-[16:0/16:0])

PropertiesImage
MNX_IDMNXM120671 Image of MNXM120671
referencechebi:186586
formulaC75H142O17P2
global charge0
mol weight1377.892
InChIKeyUMGKKHKOBCUCDP-JDVAIEAXSA-N
InChIInChI=1S/C75H142O17P2/c1-5-9-13-17-21-25-29-33-34-38-42-46-50-54-58-62-75(80)92-71(66-86-73(78)60-56-52-48-44-40-36-31-27-23-19-15-11-7-3)68-90-94(83,84)88-64-69(76)63-87-93(81,82)89-67-70(91-74(79)61-57-53-49-45-41-37-32-28-24-20-16-12-8-4)65-85-72(77)59-55-51-47-43-39-35-30-26-22-18-14-10-6-2/h21,25,33-34,69-71,76H,5-20,22-24,26-32,35-68H2,1-4H3,(H,81,82)(H,83,84)/b25-21-,34-33-/t69-,70+,71+/m0/s1
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OC[C@@H](O)COP(=O)(O)OC[C@@H](COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C75H142O17P2/c1-5-9-13-17-21-25-29-33-34-38-42-46-50-54-58-62-75(80)92-71(66-86-73(78)60-56-52-48-44-40-36-31-27-23-19-15-11-7-3)68-90-94(83,84)88-64-69(76)63-87-93(81,82)89-67-70(91-74(79)61-57-53-49-45-41-37-32-28-24-20-16-12-8-4)65-85-72(77)59-55-51-47-43-39-35-30-26-22-18-14-10-6-2/h21,25,33-34,69-71,76H,5-20,22-24,26-32,35-68H2,1-4H3,(H,81,82)(H,83,84)/b25-21-,34-33-/t69-,70+,71+/m0/s1 Image of MNXM120671
SMILES (mnx)[CH3:1][CH2:5][CH2:9][CH2:13][CH2:17]/[CH:21]=[CH:25]\[CH2:29]/[CH:33]=[CH:34]\[CH2:38][CH2:42][CH2:46][CH2:50][CH2:54][CH2:58][CH2:62][C:75](=[O:80])[O:92][C@H:71]([CH2:66][O:86][C:73]([CH2:60][CH2:56][CH2:52][CH2:48][CH2:44][CH2:40][CH2:36][CH2:31][CH2:27][CH2:23][CH2:19][CH2:15][CH2:11][CH2:7][CH3:3])=[O:78])[CH2:68][O:90][P:94]([OH:83])(=[O:84])[O:88][CH2:64][C@H:69]([CH2:63][O:87][P:93]([OH:81])(=[O:82])[O:89][CH2:67][C@@H:70]([CH2:65][O:85][C:72]([CH2:59][CH2:55][CH2:51][CH2:47][CH2:43][CH2:39][CH2:35][CH2:30][CH2:26][CH2:22][CH2:18][CH2:14][CH2:10][CH2:6][CH3:2])=[O:77])[O:91][C:74]([CH2:61][CH2:57][CH2:53][CH2:49][CH2:45][CH2:41][CH2:37][CH2:32][CH2:28][CH2:24][CH2:20][CH2:16][CH2:12][CH2:8][CH3:4])=[O:79])[OH:76]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:186586
chebi:186586
UMGKKHKOBCUCDP-JDVAIEAXSA-N 		CL(1'-[16:0/18:2(9Z,12Z)],3'-[16:0/16:0])
[(2R)-1-[[(2S)-3-[[(2R)-2,3-di(hexadecanoyloxy)propoxy]-hydroxyphosphoryl]oxy-2-hydroxypropoxy]-hydroxyphosphoryl]oxy-3-hexadecanoyloxypropan-2-yl] (9Z,12Z)-octadeca-9,12-dienoate

lipidmaps:LMGP12010115
lipidmapsM:LMGP12010115
UMGKKHKOBCUCDP-JDVAIEAXSA-N 		CL(1'-[16:0/18:2(9Z,12Z)],3'-[16:0/16:0])
1'-[1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phospho],3'-[1,2-dihexadecanoyl-sn-glycero-3-phospho]-sn-glycerol
CL 66:2
CL(16:0_16:0_16:0_18:2)
CL(66:2)
hmdb:HMDB0056392
UMGKKHKOBCUCDP-JDVAIEAXSA-N 		CL(16:0/16:0/16:0/18:2(9Z,12Z))
1'-[1,2-Dihexadecanoyl-rac-glycero-3-phospho],3'-[1,2-dihexadecanoyl-rac-glycero-3-phospho]-glycerol
1'-[1,2-Dipalmitoyl-rac-glycero-3-phospho],3'-[1,2-dipalmitoyl-rac-glycero-3-phospho]-glycerol
3-{[(2R)-2,3-bis(hexadecanoyloxy)propoxy(hydroxy)phosphoryl]oxy}-2-hydroxypropoxy((2R)-3-(hexadecanoyloxy)-2-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propoxy)phosphinic acid
CL(1'-[16:0/16:0],3'-[16:0/16:0])
CL(16:0/16:0/16:0/16:0)
CL(64:0)
Cardiolipin(16:0/16:0/16:0/16:0)
Cardiolipin(64:0)
[3-({[(2R)-2,3-bis(hexadecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy][(2R)-3-(hexadecanoyloxy)-2-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propoxy]phosphinic acid

hmdb:HMDB56392 		secondary/obsolete/fantasy identifier