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CHEBI:60319 - 1-O-palmitoyl-2-O-(5-oxovaleryl)-sn-glycero-3-phosphocholine(1+)
| Formula | C29H57NO9P |
| Net Charge | +1 |
| Average Mass | 594.747 |
| Monoisotopic Mass | 594.37655 |
| SMILES | [H]C(=O)CCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC[N+](C)(C)C |
| InChI | InChI=1S/C29H56NO9P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-20-28(32)36-25-27(39-29(33)21-18-19-23-31)26-38-40(34,35)37-24-22-30(2,3)4/h23,27H,5-22,24-26H2,1-4H3/p+1/t27-/m1/s1 |
| InChIKey | RKIDALSACBQVTN-HHHXNRCGSA-O |
| Roles Classification |
|---|
| Biological Role: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). |
| Application: | drug Any substance which when absorbed into a living organism may modify one or more of its functions. The term is generally accepted for a substance taken for a therapeutic purpose, but is also commonly used for abused substances. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-O-palmitoyl-2-O-(5-oxovaleryl)-sn-glycero-3-phosphocholine(1+) (CHEBI:60319) is a 1,2-diacyl-sn-glycero-3-phosphocholine(1+) (CHEBI:16110) |
| 1-O-palmitoyl-2-O-(5-oxovaleryl)-sn-glycero-3-phosphocholine(1+) (CHEBI:60319) is conjugate acid of 1-O-palmitoyl-2-O-(5-oxovaleryl)-sn-glycero-3-phosphocholine (CHEBI:77890) |
| Incoming Relation(s) |
| 1-O-palmitoyl-2-O-(5-oxovaleryl)-sn-glycero-3-phosphocholine (CHEBI:77890) is conjugate base of 1-O-palmitoyl-2-O-(5-oxovaleryl)-sn-glycero-3-phosphocholine(1+) (CHEBI:60319) |
| IUPAC Name |
|---|
| (7R)-4-hydroxy-N,N,N-trimethyl-10-oxo-7-[(5-oxopentanoyl)oxy]-3,5,9-trioxa-4-phosphapentacosan-1-aminium 4-oxide |
| Synonyms | Source |
|---|---|
| POVPC | ChEBI |
| 1-palmitoyl-2-(5-oxovaleryl)-sn-glycero-3-PC | ChEBI |
| 1-palmitoyl-2-(5-oxopentanoyl)-sn-glycero-3-PC | ChEBI |
| Citations |
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