| Record Information |
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| Version | 2.0 |
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| Creation Date | 2012-07-30 14:55:18 -0600 |
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| Update Date | 2015-06-03 17:21:09 -0600 |
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| Secondary Accession Numbers | |
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| Identification |
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| Name: | Cyclopropane phosphatidylethanolamine (dioctadec-11,12-cyclo-anoyl, N-C18:0 cyclo) |
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| Description | Cyclopropane phosphatidylethanolamine (dioctadec-11,12-cyclo-anoyl, n-c18:0 cyclo) belongs to the class of N-acyl Amines. These are compounds containing a fatty acid moiety linked to an amine group through an ester linkage. (inferred from compound structure) |
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| Structure | |
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| Synonyms: | - Cyclopropane phosphatidylethanolamine (dioctadec-11,12-cyclo-anoyl, n-C18:0 cyclo
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| Chemical Formula: | C43H81NO8P |
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| Weight: | Average: 771.0789
Monoisotopic: 770.569980085 |
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| InChI Key: | HCFAHMIUAQMBSN-UHFFFAOYSA-M |
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| InChI: | InChI=1S/C43H82NO8P/c1-3-5-7-19-25-37-33-39(37)27-21-15-11-9-13-17-23-29-42(47)44(31-32-51-53(49,50)52-36-41(46)35-45)43(48)30-24-18-14-10-12-16-22-28-40-34-38(40)26-20-8-6-4-2/h37-41,45-46H,3-36H2,1-2H3,(H,49,50)/p-1 |
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| CAS number: | Not Available |
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| IUPAC Name: | N-{2-[(2,3-dihydroxypropyl phosphonato)oxy]ethyl}-10-(2-hexylcyclopropyl)-N-[10-(2-hexylcyclopropyl)decanoyl]decanamide |
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| Traditional IUPAC Name: | N-{2-[(2,3-dihydroxypropyl phosphonato)oxy]ethyl}-10-(2-hexylcyclopropyl)-N-[10-(2-hexylcyclopropyl)decanoyl]decanamide |
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| SMILES: | CCCCCCC1CC1CCCCCCCCCC(=O)N(CCOP([O-])(=O)OCC(O)CO)C(=O)CCCCCCCCCC1CC1CCCCCC |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as phosphoethanolamines. Phosphoethanolamines are compounds containing a phosphate linked to the second carbon of an ethanolamine. |
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| Kingdom | Organic compounds |
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| Super Class | Organic acids and derivatives |
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| Class | Organic phosphoric acids and derivatives |
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| Sub Class | Phosphate esters |
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| Direct Parent | Phosphoethanolamines |
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| Alternative Parents | |
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| Substituents | - Phosphoethanolamine
- Dialkyl phosphate
- Alkyl phosphate
- Carboxylic acid imide, n-substituted
- N-acyl-amine
- Dicarboximide
- Carboxylic acid imide
- Secondary alcohol
- 1,2-diol
- Carboxylic acid derivative
- Organic nitrogen compound
- Organic oxygen compound
- Organopnictogen compound
- Organic oxide
- Hydrocarbon derivative
- Primary alcohol
- Organooxygen compound
- Organonitrogen compound
- Carbonyl group
- Alcohol
- Organic anion
- Aliphatic homomonocyclic compound
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| Molecular Framework | Aliphatic homomonocyclic compounds |
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| External Descriptors | |
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| Physical Properties |
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| State: | Not Available |
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| Charge: | -1 |
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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: | Not Available |
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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: | Not Available |
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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 | 45479516 | | Kegg ID | Not Available | | ChemSpider ID | Not Available | | Wikipedia ID | Not Available | | BioCyc ID | CPD0-2218 | | EcoCyc ID | CPD0-2218 |
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