Record Information |
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Version | 1.0 |
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Creation Date | 2016-09-30 23:10:13 UTC |
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Update Date | 2020-04-22 15:14:01 UTC |
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BMDB ID | BMDB0004684 |
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Secondary Accession Numbers | |
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Metabolite Identification |
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Common Name | 11,12,15-THETA |
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Description | 11,12,15-THETA, also known as 11,12,15-trihetre, belongs to the class of organic compounds known as hydroxyeicosatrienoic acids. These are eicosanoic acids with an attached hydroxyl group and three CC double bonds. Thus, 11,12,15-theta is considered to be an eicosanoid. Based on a literature review a significant number of articles have been published on 11,12,15-THETA. |
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Structure | |
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Synonyms | Value | Source |
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11,12,15-Trihydroxyicosatrienoic acid | Kegg | (5Z,8Z,13E)-(15S)-11,12,15-Trihydroxyeicosa-5,8,12-trienoic acid | Kegg | (5Z,8Z,13E)-(15S)-11,12,15-Trihydroxyicosa-5,8,12-trienoic acid | Kegg | 11,12,15-Trihydroxyicosatrienoate | Generator | (5Z,8Z,13E)-(15S)-11,12,15-Trihydroxyeicosa-5,8,12-trienoate | Generator | (5Z,8Z,13E)-(15S)-11,12,15-Trihydroxyicosa-5,8,12-trienoate | Generator | 11,12,15-TriHETRE | HMDB | 11,12,15S-Trihydroxy-5Z,8Z,13E-eicosatrienoate | HMDB | 11,12,15S-Trihydroxy-5Z,8Z,13E-eicosatrienoic acid | HMDB |
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Chemical Formula | C20H34O5 |
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Average Molecular Weight | 354.481 |
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Monoisotopic Molecular Weight | 354.240624198 |
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IUPAC Name | Not Available |
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Traditional Name | Not Available |
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CAS Registry Number | Not Available |
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SMILES | Not Available |
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InChI Identifier | InChI=1S/C20H34O5/c1-2-3-9-12-17(21)15-16-19(23)18(22)13-10-7-5-4-6-8-11-14-20(24)25/h4,6-7,10,15-19,21-23H,2-3,5,8-9,11-14H2,1H3,(H,24,25)/b6-4-,10-7-,16-15+/t17-,18?,19?/m0/s1 |
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InChI Key | PRMWQIVYOYCJQC-YZSNCDGGSA-N |
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Chemical Taxonomy |
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Description | belongs to the class of organic compounds known as hydroxyeicosatrienoic acids. These are eicosanoic acids with an attached hydroxyl group and three CC double bonds. |
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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 | Eicosanoids |
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Direct Parent | Hydroxyeicosatrienoic acids |
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Alternative Parents | |
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Substituents | - Hydroxyeicosatrienoic acid
- Long-chain fatty acid
- Hydroxy fatty acid
- Fatty acid
- Unsaturated fatty acid
- Secondary alcohol
- Carboxylic acid derivative
- Carboxylic acid
- Monocarboxylic acid or derivatives
- Polyol
- Organic oxide
- Organic oxygen compound
- Hydrocarbon derivative
- Carbonyl group
- Organooxygen compound
- Alcohol
- Aliphatic acyclic compound
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Molecular Framework | Aliphatic acyclic compounds |
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External Descriptors | |
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Ontology |
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Status | Expected but not Quantified |
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Origin | |
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Biofunction | Not Available |
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Application | Not Available |
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Cellular locations | - Cell membrane
- Cytoplasm
- Membrane
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Physical Properties |
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State | Solid |
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Experimental Properties | Property | Value | Reference |
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Melting Point | Not Available | Not Available | Boiling Point | Not Available | Not Available | Water Solubility | Not Available | Not Available | LogP | Not Available | Not Available |
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Predicted Properties | Not Available |
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Spectra |
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Spectra | |
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