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CL(i-12:0/a-21:0/i-13:0/i-13:0)[rac]

PropertiesImageOccurences in reactions
MNX_IDMNXM1110696Image of MNXM1110696
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC68H132O17P2
charge0
mass1282.89398
referencehmdb:HMDB0081712
InChIKeyVFOHVYMJXKYTGJ-QFLSEQQCSA-N
InChIInChI=1S/C68H132O17P2/c1-9-61(8)47-39-31-22-16-14-12-10-11-13-15-17-23-34-42-50-67(72)84-64(55-79-66(71)49-41-33-27-26-30-38-46-60(6)7)57-83-87(76,77)81-53-62(69)52-80-86(74,75)82-56-63(85-68(73)51-43-35-25-19-21-29-37-45-59(4)5)54-78-65(70)48-40-32-24-18-20-28-36-44-58(2)3/h58-64,69H,9-57H2,1-8H3,(H,74,75)(H,76,77)/t61?,62-,63-,64-/m1/s1
SMILESCCC(C)CCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC(C)C)COP(=O)(O)OC[C@H](O)COP(=O)(O)OC[C@@H](COC(=O)CCCCCCCCCC(C)C)OC(=O)CCCCCCCCCC(C)C
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0081712 CL(i-12:0/a-21:0/i-13:0/i-13:0)[rac]
(2S)-3-{[(2R)-2,3-bis[(11-methyldodecanoyl)oxy]propoxy(hydroxy)phosphoryl]oxy}-2-hydroxypropoxy((2R)-2-[(18-methylicosanoyl)oxy]-3-[(10-methylundecanoyl)oxy]propoxy)phosphinic acid
1'-[1-isododecanoyl-2-anteisoheneicosanoyl-sn-glycero-3-phospho],3'-[1,2-diisotridecanoyl-rac-glycero-3-phospho]-glycerol
CL(1'-[i-12:0/a-21:0],3'-[i-13:0/i-13:0])
CL(59:0)
CL(i-12:0/a-21:0/i-13:0/i-13:0)
Cardiolipin(59:0)
Cardiolipin(i-12:0/a-21:0/i-13:0/i-13:0)
[(2S)-3-({[(2R)-2,3-bis[(11-methyldodecanoyl)oxy]propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy][(2R)-2-[(18-methylicosanoyl)oxy]-3-[(10-methylundecanoyl)oxy]propoxy]phosphinic acid
hmdb:HMDB81712 secondary/obsolete/fantasy identifier