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CL(i-13:0/a-21:0/18:2(9Z,11Z)/a-21:0)[rac]

PropertiesImage
MNX_IDMNXM758080 Image of MNXM758080
referencehmdb:HMDB0073121
formulaC82H156O17P2
global charge0
mol weight1476.081
InChIKeyJIBYCXGEVIAGQX-SAMXLPCJSA-N
InChIInChI=1S/C82H156O17P2/c1-8-11-12-13-14-15-16-17-18-25-30-35-42-49-56-63-79(84)92-69-77(98-81(86)65-58-51-43-36-31-26-21-19-23-28-33-40-47-54-61-74(6)9-2)71-96-100(88,89)94-67-76(83)68-95-101(90,91)97-72-78(70-93-80(85)64-57-50-45-38-39-46-53-60-73(4)5)99-82(87)66-59-52-44-37-32-27-22-20-24-29-34-41-48-55-62-75(7)10-3/h15-18,73-78,83H,8-14,19-72H2,1-7H3,(H,88,89)(H,90,91)/b16-15-,18-17-/t74?,75?,76-,77-,78-/m1/s1
SMILESCCCCCC/C=C\C=C/CCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@@H](O)COP(=O)(O)OC[C@@H](COC(=O)CCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCC(C)CC)OC(=O)CCCCCCCCCCCCCCCCC(C)CC
MNX internals
InChI (mnx)InChI=1/C82H156O17P2/c1-8-11-12-13-14-15-16-17-18-25-30-35-42-49-56-63-79(84)92-69-77(98-81(86)65-58-51-43-36-31-26-21-19-23-28-33-40-47-54-61-74(6)9-2)71-96-100(88,89)94-67-76(83)68-95-101(90,91)97-72-78(70-93-80(85)64-57-50-45-38-39-46-53-60-73(4)5)99-82(87)66-59-52-44-37-32-27-22-20-24-29-34-41-48-55-62-75(7)10-3/h15-18,73-78,83H,8-14,19-72H2,1-7H3,(H,88,89)(H,90,91)/b16-15-,18-17-/t74?,75?,76-,77-,78-/m1/s1 Image of MNXM758080
SMILES (mnx)[CH3:1][CH2:8][CH2:11][CH2:12][CH2:13][CH2:14]/[CH:15]=[CH:16]\[CH:17]=[CH:18]/[CH2:25][CH2:30][CH2:35][CH2:42][CH2:49][CH2:56][CH2:63][C:79](=[O:84])[O:92][CH2:69][C@H:77]([CH2:71][O:96][P:100]([OH:88])(=[O:89])[O:94][CH2:67][C@H:76]([CH2:68][O:95][P:101]([OH:90])(=[O:91])[O:97][CH2:72][C@@H:78]([CH2:70][O:93][C:80]([CH2:64][CH2:57][CH2:50][CH2:45][CH2:38][CH2:39][CH2:46][CH2:53][CH2:60][CH:73]([CH3:4])[CH3:5])=[O:85])[O:99][C:82]([CH2:66][CH2:59][CH2:52][CH2:44][CH2:37][CH2:32][CH2:27][CH2:22][CH2:20][CH2:24][CH2:29][CH2:34][CH2:41][CH2:48][CH2:55][CH2:62][CH:75]([CH3:7])[CH2:10][CH3:3])=[O:87])[OH:83])[O:98][C:81]([CH2:65][CH2:58][CH2:51][CH2:43][CH2:36][CH2:31][CH2:26][CH2:21][CH2:19][CH2:23][CH2:28][CH2:33][CH2:40][CH2:47][CH2:54][CH2:61][CH:74]([CH3:6])[CH2:9][CH3:2])=[O:86]
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:HMDB0073121
JIBYCXGEVIAGQX-SAMXLPCJSA-N 		CL(i-13:0/a-21:0/18:2(9Z,11Z)/a-21:0)[rac]
2-hydroxy-3-{[hydroxy((2R)-3-[(11-methyldodecanoyl)oxy]-2-[(18-methylicosanoyl)oxy]propoxy)phosphoryl]oxy}propoxy((2R)-2-[(18-methylicosanoyl)oxy]-3-[(9Z,11Z)-octadeca-9,11-dienoyloxy]propoxy)phosphinic acid
CL(73:2)
CL(i-13:0/a-21:0/18:2(9Z,11Z)/a-21:0)
CL(i-13:0/a-21:0/18:2/a-21:0)
CL(i-13:0/a-21:0/18:2n7/a-21:0)
CL(i-13:0/a-21:0/18:2w7/a-21:0)
Cardiolipin(73:2)
Cardiolipin(i-13:0/a-21:0/18:2(9Z,11Z)/a-21:0)
Cardiolipin(i-13:0/a-21:0/18:2/a-21:0)
Cardiolipin(i-13:0/a-21:0/18:2n7/a-21:0)
Cardiolipin(i-13:0/a-21:0/18:2w7/a-21:0)
[2-hydroxy-3-({hydroxy[(2R)-3-[(11-methyldodecanoyl)oxy]-2-[(18-methylicosanoyl)oxy]propoxy]phosphoryl}oxy)propoxy][(2R)-2-[(18-methylicosanoyl)oxy]-3-[(9Z,11Z)-octadeca-9,11-dienoyloxy]propoxy]phosphinic acid

hmdb:HMDB73121 		secondary/obsolete/fantasy identifier