CHEBI:134601 - 1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine

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ChEBI Name 1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:134601
ChEBI ASCII Name 1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine
Definition A 1,2-diacyl-sn-glycero-3-phosphocholine in which the 1- and 2-acyl groups are specified as hexadecanoyl and 7-oxoheptanoyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C31H60NO9P
Net Charge 0
Average Mass 621.784
Monoisotopic Mass 621.40057
InChI InChI=1S/C31H60NO9P/c1-5-6-7-8-9-10-11-12-13-14-15-16-19-22-30(34)38-27-29(41-31(35)23-20-17-18-21-25-33)28-40-42(36,37)39-26-24-32(2,3)4/h25,29H,5-24,26-28H2,1-4H3/t29-/m1/s1
InChIKey ZFFOCRIWYYAJIJ-GDLZYMKVSA-N
SMILES O([C@H](COC(=O)CCCCCCCCCCCCCCC)COP(OCC[N+](C)(C)C)(=O)[O-])C(=O)CCCCCC([H])=O
Metabolite of Species Details
Papio hamadryas (NCBI:txid9557) See: MetaboLights Study
Roles Classification
Biological Role(s): Papio hamadryas metabolite
Any mammalian metabolite produced during a metabolic reaction in Papio hamadryas.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine (CHEBI:134601) has functional parent 7-oxoheptanoic acid (CHEBI:80588)
1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine (CHEBI:134601) has functional parent hexadecanoic acid (CHEBI:15756)
1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine (CHEBI:134601) has role Papio hamadryas metabolite (CHEBI:137684)
1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine (CHEBI:134601) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine (CHEBI:134601) is a aldehyde (CHEBI:17478)
IUPAC Name
(2R)-3-(hexadecanoyloxy)-2-[(7-oxoheptanoyl)oxy]propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine UniProt
1-palmitoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine ChEBI
PC(16:0/7:0(CHO)) ChEBI
phosphatidylcholine (16:0/7:0(CHO)) ChEBI
Last Modified
12 December 2018