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CHEBI:82848 - 1,2-dioleoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)

ChEBI IDCHEBI:82848
ChEBI Name1,2-dioleoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)
Stars
ASCII Name1,2-dioleoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)
DefinitionA 3-(3-sn-phosphatidyl)-sn-glycerol 1-phosphate in which both phosphatidyl acyl groups are specified as oleoyl.
Last Modified21 January 2016
SubmitterSteve
DownloadsMolfile
FormulaC42H80O13P2
Net Charge0
Average Mass855.037
Monoisotopic Mass854.50742
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@@H](O)COP(=O)(O)O)OC(=O)CCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C42H80O13P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(44)51-37-40(38-54-57(49,50)53-36-39(43)35-52-56(46,47)48)55-42(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,39-40,43H,3-16,21-38H2,1-2H3,(H,49,50)(H2,46,47,48)/b19-17-,20-18-/t39-,40+/m0/s1
InChIKeyFRKGQUQUVYQCIV-SQYFZQSCSA-N
Roles Classification
Biological Roles:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
1,2-dioleoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate) (CHEBI:82848) has functional parent oleic acid (CHEBI:16196)
1,2-dioleoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate) (CHEBI:82848) is a 1-(3-sn-phosphatidyl)-sn-glycerol 3-phosphate (CHEBI:37393)
1,2-dioleoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate) (CHEBI:82848) is conjugate acid of 1,2-dioleoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)(3−) (CHEBI:78907)
Incoming Relation(s)
1,2-dioleoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)(3−) (CHEBI:78907) is conjugate base of 1,2-dioleoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate) (CHEBI:82848)
IUPAC Name 
(9Z,21R,27S)-24,27,30,30-tetrahydroxy-24,30-dioxido-18-oxo-19,23,25,29-tetraoxa-24λ5,30λ5-diphosphatriacont-9-en-21-yl (9Z)-octadec-9-enoate
Synonyms  Source
PGP(18:1(9Z)/18:1(9Z))HMDB
1,2-di-(9Z-octadecenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)ChEBI
PGP(18:1/18:1)HMDB
PGP(18:1w9/18:1w9)HMDB
PGP(36:2)HMDB
PGP(18:1n9/18:1n9)HMDB
Manual XrefsDatabases
HMDB0013536HMDB