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CL(i-12:0/i-22:0/i-12:0/a-25:0)[rac]

PropertiesImage
MNX_IDMNXM1111534 Image of MNXM1111534
referencehmdb:HMDB0088908
formulaC80H156O17P2
global charge0
mol weight1452.059
InChIKeyQATUXGFJGVVWOC-MGMJZQPYSA-N
InChIInChI=1S/C80H156O17P2/c1-9-73(8)59-51-43-33-29-25-21-17-12-10-11-13-18-22-26-30-34-46-54-62-79(84)96-75(66-90-77(82)60-52-44-38-36-41-49-57-71(4)5)68-94-98(86,87)92-64-74(81)65-93-99(88,89)95-69-76(67-91-78(83)61-53-45-39-37-42-50-58-72(6)7)97-80(85)63-55-47-35-31-27-23-19-15-14-16-20-24-28-32-40-48-56-70(2)3/h70-76,81H,9-69H2,1-8H3,(H,86,87)(H,88,89)/t73?,74-,75-,76-/m1/s1
SMILESCCC(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)CCCCCCCCCCCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C80H156O17P2/c1-9-73(8)59-51-43-33-29-25-21-17-12-10-11-13-18-22-26-30-34-46-54-62-79(84)96-75(66-90-77(82)60-52-44-38-36-41-49-57-71(4)5)68-94-98(86,87)92-64-74(81)65-93-99(88,89)95-69-76(67-91-78(83)61-53-45-39-37-42-50-58-72(6)7)97-80(85)63-55-47-35-31-27-23-19-15-14-16-20-24-28-32-40-48-56-70(2)3/h70-76,81H,9-69H2,1-8H3,(H,86,87)(H,88,89)/t73?,74-,75-,76-/m1/s1 Image of MNXM1111534
SMILES (mnx)[CH3:1][CH2:9][CH:73]([CH3:8])[CH2:59][CH2:51][CH2:43][CH2:33][CH2:29][CH2:25][CH2:21][CH2:17][CH2:12][CH2:10][CH2:11][CH2:13][CH2:18][CH2:22][CH2:26][CH2:30][CH2:34][CH2:46][CH2:54][CH2:62][C:79](=[O:84])[O:96][C@H:75]([CH2:66][O:90][C:77]([CH2:60][CH2:52][CH2:44][CH2:38][CH2:36][CH2:41][CH2:49][CH2:57][CH:71]([CH3:4])[CH3:5])=[O:82])[CH2:68][O:94][P:98]([OH:86])(=[O:87])[O:92][CH2:64][C@H:74]([CH2:65][O:93][P:99]([OH:88])(=[O:89])[O:95][CH2:69][C@@H:76]([CH2:67][O:91][C:78]([CH2:61][CH2:53][CH2:45][CH2:39][CH2:37][CH2:42][CH2:50][CH2:58][CH:72]([CH3:6])[CH3:7])=[O:83])[O:97][C:80]([CH2:63][CH2:55][CH2:47][CH2:35][CH2:31][CH2:27][CH2:23][CH2:19][CH2:15][CH2:14][CH2:16][CH2:20][CH2:24][CH2:28][CH2:32][CH2:40][CH2:48][CH2:56][CH:70]([CH3:2])[CH3:3])=[O:85])[OH:81]
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
hmdb:HMDB0088908
QATUXGFJGVVWOC-MGMJZQPYSA-N 		CL(i-12:0/i-22:0/i-12:0/a-25:0)[rac]
1'-[1-isododecanoyl-2-isodocosanoyl-sn-glycero-3-phospho],3'-[1,2-diisododecanoyl-rac-glycero-3-phospho]-glycerol
2-hydroxy-3-{[hydroxy((2R)-2-[(22-methyltetracosanoyl)oxy]-3-[(10-methylundecanoyl)oxy]propoxy)phosphoryl]oxy}propoxy((2R)-2-[(20-methylhenicosanoyl)oxy]-3-[(10-methylundecanoyl)oxy]propoxy)phosphinic acid
CL(1'-[i-12:0/i-22:0],3'-[i-12:0/i-12:0])
CL(58:0)
CL(71:0)
CL(i-12:0/i-22:0/i-12:0/a-25:0)
CL(i-12:0/i-22:0/i-12:0/i-12:0)
Cardiolipin(58:0)
Cardiolipin(71:0)
Cardiolipin(i-12:0/i-22:0/i-12:0/a-25:0)
Cardiolipin(i-12:0/i-22:0/i-12:0/i-12:0)
[2-hydroxy-3-({hydroxy[(2R)-2-[(22-methyltetracosanoyl)oxy]-3-[(10-methylundecanoyl)oxy]propoxy]phosphoryl}oxy)propoxy][(2R)-2-[(20-methylhenicosanoyl)oxy]-3-[(10-methylundecanoyl)oxy]propoxy]phosphinic acid

hmdb:HMDB88908 		secondary/obsolete/fantasy identifier