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CHEBI:83582 - 1,1',2-trilinoleoyl-2'-oleoyl cardiolipin(2−)

ChEBI IDCHEBI:83582
ChEBI Name1,1',2-trilinoleoyl-2'-oleoyl cardiolipin(2−)
Stars
ASCII Name1,1',2-trilinoleoyl-2'-oleoyl cardiolipin(2-)
DefinitionA cardiolipin 72:7(2−) obtained by deprotonation of the phosphate OH groups of 1,1',2-trilinoleoyl-2'-oleoyl cardiolipin; major species at pH 7.3.
Last Modified30 April 2021
Submitterlaimo
DownloadsMolfile
FormulaC81H142O17P2
Net Charge-2
Average Mass1449.958
Monoisotopic Mass1448.97332
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC(O)COP(=O)([O-])OC[C@@H](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
InChIInChI=1S/C81H144O17P2/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-61-65-78(83)91-71-76(97-80(85)67-63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)73-95-99(87,88)93-69-75(82)70-94-100(89,90)96-74-77(98-81(86)68-64-60-56-52-48-44-40-36-32-28-24-20-16-12-8-4)72-92-79(84)66-62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2/h21-23,25-27,33-40,75-77,82H,5-20,24,28-32,41-74H2,1-4H3,(H,87,88)(H,89,90)/p-2/b25-21-,26-22-,27-23-,37-33-,38-34-,39-35-,40-36-/t75?,76-,77-/m1/s1
InChIKeyWSEKMBMSQDAXBT-NBWTYSCASA-L
ChEBI Ontology
Outgoing Relation(s)
1,1',2-trilinoleoyl-2'-oleoyl cardiolipin(2−) (CHEBI:83582) is a cardiolipin 72:7(2−) (CHEBI:72899)
1,1',2-trilinoleoyl-2'-oleoyl cardiolipin(2−) (CHEBI:83582) is conjugate base of 1,1',2-trilinoleoyl-2'-oleoyl cardiolipin (CHEBI:84399)
Incoming Relation(s)
1,1',2-trilinoleoyl-2'-oleoyl cardiolipin (CHEBI:84399) is conjugate acid of 1,1',2-trilinoleoyl-2'-oleoyl cardiolipin(2−) (CHEBI:83582)
IUPAC Name 
(2R)-2,3-bis[(9Z,12Z)-octadeca-9,12-dienoyloxy]propyl 2-hydroxypropane-1,3-diyl (2R)-3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]-2-[(9Z)-octadec-9-enoyloxy]propyl bis(phosphate)
Synonyms  Source
1'-[1,2-dilinoleoyl-sn-glycero-3-phospho]-3'-[1-linoleoyl-2-oleoyl-sn-glycero-3-phospho]-glycerol(2−)SUBMITTER
1,1',2-trilinoleoyl-2'-oleoyl CL(2−)SUBMITTER
CL(18:2(9Z,12Z)/18:2(9Z,12Z)/18:2(9Z,12Z)/18:1(9Z))(2−)ChEBI
UniProt Name  Source
1'-[1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phospho]-3'-[1-(9Z,12Z-octadecadienoyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phospho]-glycerolUniProt