1-(6Z,9Z,12Z,15Z-heneicosatetraenoyl)-sn-glycero-3-phosphate
Basic information
- CAS
1037125-07-7- Standard SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@@H](O)COP(=O)(O)O- InChIKey
QGRGKKKASAUUCG-MDGVENSFSA-N- Molecular formula
- C24H41O7P
- Average molar mass
- 472.6 g/mol
- Monoisotopic mass
- 472.25899064
Overview
PA(21:4(6Z,9Z,12Z,15Z)/0:0) is a 1-acyl-sn-glycerol 3-phosphate.
Names & identifiers
- Preferred name
- 1-(6Z,9Z,12Z,15Z-heneicosatetraenoyl)-sn-glycero-3-phosphate
- IUPAC
- [(2R)-2-hydroxy-3-phosphonooxypropyl] (6Z,9Z,12Z,15Z)-henicosa-6,9,12,15-tetraenoate
Names & synonyms
PA(21:4(6Z,9Z,12Z,15Z)/0:0)1-(6Z,9Z,12Z,15Z-heneicosatetraenoyl)-sn-glycero-3-phosphateCHEBI:187152DTXSID701384929LPA 21:4LMGP10050003[(2R)-2-hydroxy-3-phosphonooxypropyl] (6Z,9Z,12Z,15Z)-henicosa-6,9,12,15-tetraenoatePA(21:4/0:0)PA(21:4/0:0); LPA(21:4)PA 21:4(6Z,9Z,12Z,15Z)/0:0(2R)-2-Hydroxy-3-(phosphonooxy)propyl (6Z,9Z,12Z,15Z)-6,9,12,15-heneicosatetraenoate1037125-07-7
Database identifiers
- CAS
1037125-07-7- PubChem CID
- 5283535
- DTXSID
DTXSID701384929- ChEBI
CHEBI:187152
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 21
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 620
Experimental & physicochemical properties
LipidsLipids -> Glycerophospholipids [GP] -> Glycerophosphates [GP10] -> Monoacylglycerophosphates [GP1005]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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