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CHEBI:73998 - 1-hexadecanoyl-2-[(9Z)-hexadec-9-enoyl]-sn-glycero-3-phosphate(2−)

ChEBI IDCHEBI:73998
ChEBI Name1-hexadecanoyl-2-[(9Z)-hexadec-9-enoyl]-sn-glycero-3-phosphate(2−)
Stars
ASCII Name1-hexadecanoyl-2-[(9Z)-hexadec-9-enoyl]-sn-glycero-3-phosphate(2-)
DefinitionA 1,2-diacyl-sn-glycerol 3-phosphate(2−) ion in which the acyl groups at C-1 and C-2 are hexadecanoyl and (9Z)-hexadec-9-enoyl respectively.
Last Modified6 August 2013
Submitterabridge
DownloadsMolfile
FormulaC35H65O8P
Net Charge-2
Average Mass644.871
Monoisotopic Mass644.44280
SMILES[H][C@@](COC(=O)CCCCCCCCCCCCCCC)(COP(=O)([O-])[O-])OC(=O)CCCCCCC/C=C\CCCCCC
InChIInChI=1S/C35H67O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(36)41-31-33(32-42-44(38,39)40)43-35(37)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h14,16,33H,3-13,15,17-32H2,1-2H3,(H2,38,39,40)/p-2/b16-14-/t33-/m1/s1
InChIKeySCNLPRDASXIFJK-BSAOHMCWSA-L
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
1-hexadecanoyl-2-[(9Z)-hexadec-9-enoyl]-sn-glycero-3-phosphate(2−) (CHEBI:73998) is a 1,2-diacyl-sn-glycerol 3-phosphate(2−) (CHEBI:58608)
IUPAC Name 
(2R)-3-(hexadecanoyloxy)-2-[(9Z)-hexadec-9-enoyloxy]propyl phosphate
Synonyms  Source
PA(16:0/16:1(9Z))SUBMITTER
1-hexadecanoyl-2-(9Z-hexadecenoyl)-sn-glycero-3-phosphate(2−)ChEBI
(2R)-2-[(9Z)-hexadec-9-enoyloxy]-3-(palmitoyloxy)propyl phosphateIUPAC
UniProt Name  Source
1-hexadecanoyl-2-[(9Z)-hexadec-9-enoyl]-sn-glycero-3-phosphateUniProt
Manual XrefsDatabases
LMGP10010911LIPID MAPS