Record Information |
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Version | 2.0 |
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Creation Date | 2015-09-08 20:07:54 -0600 |
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Update Date | 2015-12-09 12:15:48 -0700 |
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Secondary Accession Numbers | |
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Identification |
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Name: | DG(12:0(3-OH)/18:1(9Z)/0:0) |
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Description | DG(12:0(3-OH)/18:1(9Z)/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)/18:1(9Z)/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: | C33H62O6 |
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Weight: | Average: 554.853 Monoisotopic: 554.454639716 |
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InChI Key: | BPODHYBQHQVWEP-RHKBQCMMSA-N |
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InChI: | InChI=1S/C33H62O6/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-22-24-26-32(36)38-28-31(35)29-39-33(37)27-30(34)25-23-21-19-10-8-6-4-2/h14-15,30-31,34-35H,3-13,16-29H2,1-2H3/b15-14-/t30?,31-/m1/s1 |
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CAS number: | Not Available |
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IUPAC Name: | (2R)-2-hydroxy-3-[(3-hydroxydodecanoyl)oxy]propyl (9Z)-octadec-9-enoate |
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Traditional IUPAC Name: | (2R)-2-hydroxy-3-[(3-hydroxydodecanoyl)oxy]propyl (9Z)-octadec-9-enoate |
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SMILES: | [H][C@@](O)(COC(=O)CCCCCCC\C=C/CCCCCCCC)COC(=O)CC(O)CCCCCCCCC |
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Chemical Taxonomy |
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Description | 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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SMPDB Pathways: | phospholipid biosynthesis (CL(12:0(3-OH)/18:1(9Z)/12:0(3-OH)/18:1(9Z))) | PW001924 | |
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KEGG Pathways: | Not Available |
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EcoCyc Pathways: | Not Available |
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Concentrations |
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| 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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