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CL(i-12:0/18:2(9Z,11Z)/i-12:0/a-25:0)[rac]

PropertiesImage
MNX_IDMNXM1110380 Image of MNXM1110380
referencehmdb:HMDB0080408
formulaC76H144O17P2
global charge0
mol weight1391.919
InChIKeyUKJKIJWWMZAJND-JXYAGKPCSA-N
InChIInChI=1S/C76H144O17P2/c1-8-10-11-12-13-14-15-16-21-25-28-31-34-45-52-59-75(80)92-71(63-86-73(78)57-50-43-38-36-40-47-54-67(3)4)65-90-94(82,83)88-61-70(77)62-89-95(84,85)91-66-72(64-87-74(79)58-51-44-39-37-41-48-55-68(5)6)93-76(81)60-53-46-35-32-29-26-23-20-18-17-19-22-24-27-30-33-42-49-56-69(7)9-2/h14-16,21,67-72,77H,8-13,17-20,22-66H2,1-7H3,(H,82,83)(H,84,85)/b15-14-,21-16-/t69?,70-,71+,72+/m0/s1
SMILESCCCCCC/C=C\C=C/CCCCCCCC(=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)CCCCCCCCCCCCCCCCCCCCC(C)CC
MNX internals
InChI (mnx)InChI=1/C76H144O17P2/c1-8-10-11-12-13-14-15-16-21-25-28-31-34-45-52-59-75(80)92-71(63-86-73(78)57-50-43-38-36-40-47-54-67(3)4)65-90-94(82,83)88-61-70(77)62-89-95(84,85)91-66-72(64-87-74(79)58-51-44-39-37-41-48-55-68(5)6)93-76(81)60-53-46-35-32-29-26-23-20-18-17-19-22-24-27-30-33-42-49-56-69(7)9-2/h14-16,21,67-72,77H,8-13,17-20,22-66H2,1-7H3,(H,82,83)(H,84,85)/b15-14-,21-16-/t69?,70-,71+,72+/m0/s1 Image of MNXM1110380
SMILES (mnx)[CH3:1][CH2:8][CH2:10][CH2:11][CH2:12][CH2:13]/[CH:14]=[CH:15]\[CH:16]=[CH:21]/[CH2:25][CH2:28][CH2:31][CH2:34][CH2:45][CH2:52][CH2:59][C:75](=[O:80])[O:92][C@H:71]([CH2:63][O:86][C:73]([CH2:57][CH2:50][CH2:43][CH2:38][CH2:36][CH2:40][CH2:47][CH2:54][CH:67]([CH3:3])[CH3:4])=[O:78])[CH2:65][O:90][P:94]([OH:82])(=[O:83])[O:88][CH2:61][C@@H:70]([CH2:62][O:89][P:95]([OH:84])(=[O:85])[O:91][CH2:66][C@@H:72]([CH2:64][O:87][C:74]([CH2:58][CH2:51][CH2:44][CH2:39][CH2:37][CH2:41][CH2:48][CH2:55][CH:68]([CH3:5])[CH3:6])=[O:79])[O:93][C:76]([CH2:60][CH2:53][CH2:46][CH2:35][CH2:32][CH2:29][CH2:26][CH2:23][CH2:20][CH2:18][CH2:17][CH2:19][CH2:22][CH2:24][CH2:27][CH2:30][CH2:33][CH2:42][CH2:49][CH2:56][CH:69]([CH3:7])[CH2:9][CH3:2])=[O:81])[OH:77]
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:HMDB0080408
UKJKIJWWMZAJND-JXYAGKPCSA-N 		CL(i-12:0/18:2(9Z,11Z)/i-12:0/a-25:0)[rac]
(2R)-2-hydroxy-3-{[hydroxy((2R)-2-[(22-methyltetracosanoyl)oxy]-3-[(10-methylundecanoyl)oxy]propoxy)phosphoryl]oxy}propoxy((2R)-3-[(10-methylundecanoyl)oxy]-2-[(9Z,11Z)-octadeca-9,11-dienoyloxy]propoxy)phosphinic acid
CL(67:2)
CL(i-12:0/18:2(9Z,11Z)/i-12:0/a-25:0)
CL(i-12:0/18:2/i-12:0/a-25:0)
CL(i-12:0/18:2n7/i-12:0/a-25:0)
CL(i-12:0/18:2w7/i-12:0/a-25:0)
Cardiolipin(67:2)
Cardiolipin(i-12:0/18:2(9Z,11Z)/i-12:0/a-25:0)
Cardiolipin(i-12:0/18:2/i-12:0/a-25:0)
Cardiolipin(i-12:0/18:2n7/i-12:0/a-25:0)
Cardiolipin(i-12:0/18:2w7/i-12:0/a-25:0)
[(2R)-2-hydroxy-3-({hydroxy[(2R)-2-[(22-methyltetracosanoyl)oxy]-3-[(10-methylundecanoyl)oxy]propoxy]phosphoryl}oxy)propoxy][(2R)-3-[(10-methylundecanoyl)oxy]-2-[(9Z,11Z)-octadeca-9,11-dienoyloxy]propoxy]phosphinic acid

hmdb:HMDB80408 		secondary/obsolete/fantasy identifier