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Record Information |
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| Version |
1.0 |
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| Update Date |
1/22/2018 11:54:54 AM |
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Metabolite ID | PAMDB001933 |
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Identification |
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| Name: |
Heptadecenoic acid |
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| Description: | Heptadecenoic acid is a member of the chemical class known as Unsaturated Fatty Acids. These are fatty acids whose chain contains at least one CC double bond. (inferred from compound structure) |
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Structure |
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| Synonyms: | - (E)-Heptadec-9-enoate
- (E)-Heptadec-9-enoic acid
- 9E-Heptadecenoate
- 9E-Heptadecenoic acid
- Heptadecenoate
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Chemical Formula: |
C17H32O2 |
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| Average Molecular Weight: |
268.4348 |
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| Monoisotopic Molecular
Weight: |
268.240230268 |
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| InChI Key: |
GEHPRJRWZDWFBJ-FOCLMDBBSA-N |
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| InChI: | InChI=1S/C17H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h15-16H,2-14H2,1H3,(H,18,19)/b16-15+ |
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| CAS
number: |
26265-99-6 |
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| IUPAC Name: | (2E)-heptadec-2-enoic acid |
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Traditional IUPAC Name: |
2-heptadecylenic acid |
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| SMILES: | [H]\C(CCCCCCCCCCCCCC)=C(\[H])C(O)=O |
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Chemical Taxonomy |
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Taxonomy Description | This compound belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms. |
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Kingdom |
Organic compounds |
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| Super Class | Lipids and lipid-like molecules |
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Class |
Fatty Acyls |
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| Sub Class | Fatty acids and conjugates |
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Direct Parent |
Long-chain fatty acids |
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| Alternative Parents |
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| Substituents |
- Long-chain fatty acid
- Unsaturated fatty acid
- Straight chain fatty acid
- Monocarboxylic acid or derivatives
- Carboxylic acid
- Carboxylic acid derivative
- Hydrocarbon derivative
- Organooxygen compound
- Carbonyl group
- Aliphatic acyclic compound
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| Molecular Framework |
Aliphatic acyclic 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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Pathways: |
Not Available |
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Spectra |
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| Spectra: |
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References |
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| References: |
- van der Werf, M. J., Overkamp, K. M., Muilwijk, B., Coulier, L., Hankemeier, T. (2007). "Microbial metabolomics: toward a platform with full metabolome coverage." Anal Biochem 370:17-25. Pubmed: 17765195
- 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 | 5282747 | | Kegg ID | C16536 | | ChemSpider ID | 4445874 | | Wikipedia ID | Not Available | | BioCyc ID | Not Available |
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