EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:74832 - 12-aminolauroyl tripalmitoyl cardiolipin(2−)

ChEBI IDCHEBI:74832
ChEBI Name12-aminolauroyl tripalmitoyl cardiolipin(2−)
Stars
ASCII Name12-aminolauroyl tripalmitoyl cardiolipin(2-)
DefinitionAn organophosphate oxoanion resulting from deprotonation of the two phosphate OH groups of 12-aminolauroyl tripalmitoyl cardiolipin.
Last Modified22 July 2013
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC69H133NO17P2
Net Charge-2
Average Mass1310.761
Monoisotopic Mass1309.90597
SMILESCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@H](O)COP(=O)([O-])OC[C@@H](COC(=O)CCCCCCCCCCCN)OC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC
InChIInChI=1S/C69H135NO17P2/c1-4-7-10-13-16-19-22-25-28-32-37-42-47-52-66(72)80-59-64(86-68(74)54-49-44-39-33-29-26-23-20-17-14-11-8-5-2)61-84-88(76,77)82-57-63(71)58-83-89(78,79)85-62-65(60-81-67(73)53-48-43-38-35-31-36-41-46-51-56-70)87-69(75)55-50-45-40-34-30-27-24-21-18-15-12-9-6-3/h63-65,71H,4-62,70H2,1-3H3,(H,76,77)(H,78,79)/p-2/t63-,64+,65+/m0/s1
InChIKeyJMVSWAMUHZZHJC-MGSXVFSVSA-L
ChEBI Ontology
Outgoing Relation(s)
12-aminolauroyl tripalmitoyl cardiolipin(2−) (CHEBI:74832) is a organophosphate oxoanion (CHEBI:58945)
12-aminolauroyl tripalmitoyl cardiolipin(2−) (CHEBI:74832) is conjugate base of 12-aminolauroyl tripalmitoyl cardiolipin (CHEBI:74829)
Incoming Relation(s)
12-aminolauroyl tripalmitoyl cardiolipin diammonium salt (CHEBI:74834) has part 12-aminolauroyl tripalmitoyl cardiolipin(2−) (CHEBI:74832)
12-aminolauroyl tripalmitoyl cardiolipin (CHEBI:74829) is conjugate acid of 12-aminolauroyl tripalmitoyl cardiolipin(2−) (CHEBI:74832)
IUPAC Name 
(2R)-3-[(12-aminododecanoyl)oxy]-2-(hexadecanoyloxy)propyl (2R)-2,3-bis(hexadecanoyloxy)propyl 2-hydroxypropane-1,3-diyl bis(phosphate)
Synonyms  Source
(2R)-3-[(12-aminododecanoyl)oxy]-2-(palmitoyloxy)propyl (2R)-2,3-bis(palmitoyloxy)propyl 2-hydroxypropane-1,3-diyl bis(phosphate)IUPAC
12-aminolauroyl tripalmitoyl cardiolipin dianionChEBI