| Record Information |
|---|
| Version | 1.0 |
|---|
| Creation Date | 2020-03-25 16:05:53 UTC |
|---|
| Update Date | 2020-05-11 19:21:30 UTC |
|---|
| BMDB ID | BMDB0096705 |
|---|
| Secondary Accession Numbers | None |
|---|
| Metabolite Identification |
|---|
| Common Name | LysoPA(0:0/18:2(9Z,12Z)) |
|---|
| Description | LysoPA(0:0/18:2(9Z,12Z)) is a lysophosphatidic acid. It is a glycerophospholipid in which a phosphate moiety occupies a glycerol substitution site. Lysophosphatidic acids can have different combinations of fatty acids of varying lengths and saturation attached at the C-1 (sn-1) or C-2 (sn-2) position. Fatty acids containing 16 and 18 carbons are the most common.LysoPA(0:0/18:2(9Z,12Z)), in particular, consists of one 9Z,12Z-octadecadienoyl chain. Lysophosphatidic acid is the simplest possible glycerophospholipid. It is the biosynthetic precursor of phosphatidic acid. Although it is present at very low levels only in animal tissues, it is extremely important biologically, influencing many biochemical processes. |
|---|
| Structure | |
|---|
| Synonyms | | Value | Source |
|---|
| {3-hydroxy-2-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propoxy}phosphonate | HMDB | | LPA(18:2) | HMDB | | LPA(0:0/18:2(9Z,12Z)) | HMDB | | 2-(9Z,12Z-Octadecadienoyl)-phosphatidic acid | HMDB | | Lysophosphatidic acid(18:2) | HMDB | | 2-Linoleoyl-glycero-3-phosphate | HMDB | | Lysophosphatidic acid(0:0/18:2) | HMDB | | 2-(9Z,12Z-Octadecadienoyl)-glycero-3-phosphate | HMDB | | LPA(0:0/18:2) | HMDB |
|
|---|
| Chemical Formula | C21H39O7P |
|---|
| Average Molecular Weight | 434.51 |
|---|
| Monoisotopic Molecular Weight | 434.243340594 |
|---|
| IUPAC Name | {3-hydroxy-2-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propoxy}phosphonic acid |
|---|
| Traditional Name | 3-hydroxy-2-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propoxyphosphonic acid |
|---|
| CAS Registry Number | Not Available |
|---|
| SMILES | CCCCC\C=C/C\C=C/CCCCCCCC(=O)OC(CO)COP(O)(O)=O |
|---|
| InChI Identifier | InChI=1S/C21H39O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)28-20(18-22)19-27-29(24,25)26/h6-7,9-10,20,22H,2-5,8,11-19H2,1H3,(H2,24,25,26)/b7-6-,10-9- |
|---|
| InChI Key | PALVOIADDFXQGT-HZJYTTRNSA-N |
|---|
| Chemical Taxonomy |
|---|
| Description | belongs to the class of organic compounds known as 2-acylglycerol-3-phosphates. These are lysophosphatidic acids where the glycerol is esterified with a fatty acid at O-2 position. |
|---|
| Kingdom | Organic compounds |
|---|
| Super Class | Lipids and lipid-like molecules |
|---|
| Class | Glycerophospholipids |
|---|
| Sub Class | Glycerophosphates |
|---|
| Direct Parent | 2-acylglycerol-3-phosphates |
|---|
| Alternative Parents | |
|---|
| Substituents | - 2-acylglycerol-3-phosphate
- Fatty acid ester
- Monoalkyl phosphate
- Fatty acyl
- Alkyl phosphate
- Organic phosphoric acid derivative
- Phosphoric acid ester
- Carboxylic acid ester
- Carboxylic acid derivative
- Monocarboxylic acid or derivatives
- Alcohol
- Hydrocarbon derivative
- Organic oxide
- Organic oxygen compound
- Carbonyl group
- Primary alcohol
- Organooxygen compound
- Aliphatic acyclic compound
|
|---|
| Molecular Framework | Aliphatic acyclic compounds |
|---|
| External Descriptors | Not Available |
|---|
| Ontology |
|---|
| Status | Expected but not Quantified |
|---|
| Origin | |
|---|
| Biofunction | Not Available |
|---|
| Application | Not Available |
|---|
| Cellular locations | |
|---|
| Physical Properties |
|---|
| State | Not Available |
|---|
| Experimental Properties | | Property | Value | Reference |
|---|
| Melting Point | Not Available | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | LogP | Not Available | Not Available |
|
|---|
| Predicted Properties | |
|---|
| Spectra |
|---|
| Spectra | |
|---|
