CHEBI:136816 - 1-oleoyl-2-hexadecanoyl-sn-glycero-3-phospho-(1ʼ-sn-glycerol-3ʼ-phosphate)

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ChEBI Name 1-oleoyl-2-hexadecanoyl-sn-glycero-3-phospho-(1ʼ-sn-glycerol-3ʼ-phosphate)
ChEBI ID CHEBI:136816
ChEBI ASCII Name 1-oleoyl-2-hexadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)
Definition A 3-(3-sn-phosphatidyl)-sn-glycerol 1-phosphate in which the phosphatidyl acyl groups at positions 1 and 2 are specified as oleoyl and hexadecanoyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C40H78O13P2
Net Charge 0
Average Mass 828.989
Monoisotopic Mass 828.49177
InChI InChI=1S/C40H78O13P2/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-39(42)49-35-38(36-52-55(47,48)51-34-37(41)33-50-54(44,45)46)53-40(43)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h17-18,37-38,41H,3-16,19-36H2,1-2H3,(H,47,48)(H2,44,45,46)/b18-17-/t37-,38+/m0/s1
InChIKey WQMDYQSTTXRXLQ-HGWHEPCSSA-N
SMILES O([C@@H](COP(=O)(OC[C@H](COP(=O)(O)O)O)O)COC(CCCCCCC/C=C\CCCCCCCC)=O)C(CCCCCCCCCCCCCCC)=O
Metabolite of Species Details
Brassica napus (NCBI:txid3708) See: PubMed
Brassica napus (NCBI:txid3708) See: MetaboLights Study
Roles Classification
Biological Role(s): Brassica napus metabolite
Any plant metabolite that is produced by rapeseed (Brassica napus).
Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
(via phosphatidylglycerol )
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
(via phosphatidylglycerol )
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ChEBI Ontology
Outgoing 1-oleoyl-2-hexadecanoyl-sn-glycero-3-phospho-(1ʼ-sn-glycerol-3ʼ-phosphate) (CHEBI:136816) has functional parent hexadecanoic acid (CHEBI:15756)
1-oleoyl-2-hexadecanoyl-sn-glycero-3-phospho-(1ʼ-sn-glycerol-3ʼ-phosphate) (CHEBI:136816) has functional parent oleic acid (CHEBI:16196)
1-oleoyl-2-hexadecanoyl-sn-glycero-3-phospho-(1ʼ-sn-glycerol-3ʼ-phosphate) (CHEBI:136816) has role Brassica napus metabolite (CHEBI:140165)
1-oleoyl-2-hexadecanoyl-sn-glycero-3-phospho-(1ʼ-sn-glycerol-3ʼ-phosphate) (CHEBI:136816) is a 1-(3-sn-phosphatidyl)-sn-glycerol 3-phosphate (CHEBI:37393)
IUPAC Name
(2R,8S)-2-(hexadecanoyloxy)-5,8,11,11-tetrahydroxy-5,11-dioxo-4,6,10-trioxa-5λ5,11λ5-diphosphaundecan-1-yl (9Z)-octadec-9-enoate
Synonyms Sources
1-(9Z-octadecenoyl)-2-hexadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate) ChEBI
1-[(9Z)-octadecenoyl]-2-hexadcanoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate) ChEBI
1-oleoyl-2-palmitoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate) ChEBI
PGP(18:1(9Z)/16:0) HMDB
PGP(18:1n9/16:0) HMDB
Phosphatidylglycerophosphate (1-octadecenoyl(9Z),2-palmitoyl) ChEBI
phosphatidylglycerophosphate 18:1(9Z)/16:0 ChEBI
Manual Xref Database
HMDB0013532 HMDB
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Last Modified
16 April 2018