Record Information |
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Version | 2.0 |
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Creation Date | 2015-06-04 15:13:44 -0600 |
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Update Date | 2015-07-23 12:06:48 -0600 |
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Secondary Accession Numbers | |
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Identification |
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Name: | Alkanesulfonate |
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Description | |
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Structure | |
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Synonyms: | - Alkanesulfonic acid
- Alkanesulphonate
- Alkanesulphonic acid
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Chemical Formula: | C18H24O3 |
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Weight: | Average: 288.3814 Monoisotopic: 288.172544634 |
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InChI Key: | GKCNNWJPOJGTLV-UKTHLTGXSA-N |
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InChI: | InChI=1S/C18H24O3/c1-12(2)7-6-8-13(3)9-10-15-14(4)16(19)11-17(21-5)18(15)20/h7,9,11H,6,8,10H2,1-5H3/b13-9+ |
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CAS number: | Not Available |
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IUPAC Name: | 3-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-5-methoxy-2-methylcyclohexa-2,5-diene-1,4-dione |
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Traditional IUPAC Name: | 3-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-5-methoxy-2-methylcyclohexa-2,5-diene-1,4-dione |
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SMILES: | COC1=CC(=O)C(C)=C(C\C=C(/C)CCC=C(C)C)C1=O |
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Chemical Taxonomy |
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Description | belongs to the class of organic compounds known as prenylquinones. These are quinones with a structure characterized by the quinone ring substituted by an prenyl side-chain. |
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Kingdom | Organic compounds |
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Super Class | Lipids and lipid-like molecules |
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Class | Prenol lipids |
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Sub Class | Quinone and hydroquinone lipids |
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Direct Parent | Prenylquinones |
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Alternative Parents | |
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Substituents | - Prenylbenzoquinone
- Monoterpenoid
- Monocyclic monoterpenoid
- Quinone
- P-benzoquinone
- Vinylogous ester
- Cyclic ketone
- Ketone
- Organic oxygen compound
- Organic oxide
- Hydrocarbon derivative
- Organooxygen compound
- Carbonyl group
- Aliphatic homomonocyclic compound
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Molecular Framework | Aliphatic homomonocyclic 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: | |
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KEGG Pathways: | |
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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 | HMDB0060353 | Pubchem Compound ID | 10902296 | Kegg ID | C15521 | ChemSpider ID | Not Available | Wikipedia ID | Not Available | BioCyc ID | Not Available |
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