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Record Information |
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| Version |
1.0 |
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| Update Date |
1/22/2018 12:54:54 PM |
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Metabolite ID | PAMDB006871 |
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Identification |
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| Name: |
DG(12:0(3-OH)/14:0(3-OH)/0:0) |
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| Description: | DG(12:0(3-OH)/14:0(3-OH)/0:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. DG(12:0(3-OH)/14:0(3-OH)/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway. |
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Structure |
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| Synonyms: | Not Available |
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Chemical Formula: |
C29H56O7 |
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| Average Molecular Weight: |
516.76 |
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| Monoisotopic Molecular
Weight: |
516.402604143 |
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| InChI Key: |
LPPNPQKCSQHWBL-RCSZBHJWSA-N |
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| InChI: | InChI=1S/C29H56O7/c1-3-5-7-9-11-12-14-16-18-20-26(31)22-29(34)36-24-27(32)23-35-28(33)21-25(30)19-17-15-13-10-8-6-4-2/h25-27,30-32H,3-24H2,1-2H3/t25?,26?,27-/m0/s1 |
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| CAS
number: |
Not Available |
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| IUPAC Name: | (2S)-2-hydroxy-3-[(3-hydroxydodecanoyl)oxy]propyl 3-hydroxytetradecanoate |
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Traditional IUPAC Name: |
(2S)-2-hydroxy-3-[(3-hydroxydodecanoyl)oxy]propyl 3-hydroxytetradecanoate |
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| SMILES: | [H][C@](O)(COC(=O)CC(O)CCCCCCCCC)COC(=O)CC(O)CCCCCCCCCCC |
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Chemical Taxonomy |
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Taxonomy Description | This compound belongs to the class of organic compounds known as 1,3-diacylglycerols. These are diacylglycerols containing a glycerol acylated at positions 1 and 3. |
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Kingdom |
Organic compounds |
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| Super Class | Lipids and lipid-like molecules |
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Class |
Glycerolipids |
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| Sub Class | Diradylglycerols |
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Direct Parent |
1,3-diacylglycerols |
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| Alternative Parents |
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| Substituents |
- 1,3-acyl-sn-glycerol
- Fatty alcohol
- Beta-hydroxy acid
- Fatty acid ester
- Dicarboxylic acid or derivatives
- Fatty acyl
- Hydroxy acid
- Carboxylic acid ester
- Secondary alcohol
- Carboxylic acid derivative
- Hydrocarbon derivative
- Organic oxygen compound
- Carbonyl group
- Organic oxide
- Alcohol
- Organooxygen compound
- Aliphatic acyclic compound
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| Molecular Framework |
Aliphatic acyclic compounds |
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| External Descriptors |
Not Available |
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Physical Properties |
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| State: |
Not Available |
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| Charge: | 0 |
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Melting point: |
Not Available |
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| Experimental Properties: |
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| Predicted Properties |
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Biological Properties |
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| Cellular Locations: |
Membrane |
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| Reactions: | |
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Pathways: |
Not Available |
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Spectra |
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| Spectra: |
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References |
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| References: |
- Yurtsever D. (2007). Fatty acid methyl ester profiling of Enterococcus and Esherichia coli for microbial source tracking. M.sc. Thesis. Villanova University: U.S.A
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| Synthesis Reference: |
Not Available |
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| Material Safety Data Sheet (MSDS) |
Not Available |
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Links |
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| External Links: |
| Resource | Link |
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| CHEBI ID | Not Available | | HMDB ID | Not Available | | Pubchem Compound ID | Not Available | | Kegg ID | Not Available | | ChemSpider ID | Not Available | | Wikipedia ID | Not Available | | BioCyc ID | Not Available |
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