Record Information |
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Version | 2.0 |
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Creation Date | 2012-10-22 13:35:00 -0600 |
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Update Date | 2015-06-03 17:26:43 -0600 |
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Secondary Accession Numbers | |
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Identification |
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Name: | 3-(all-trans-hexaprenyl)benzene-1,2-diol |
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Description | 3-(all-trans-hexaprenyl)benzene-1,2-diol is involved in the ubiquinone biosynthetic pathway. It is a substrate for the 3-demethylubiquinone-9 3-methyltransferase that catalyses the following reaction: S-adenosyl-L-methionine + 3-(all-trans-hexaprenyl)benzene-1,2-diol = S-adenosyl-L-homocysteine + 2-methoxy-6-(all-trans-hexaprenyl)phenol. |
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Structure | |
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Synonyms: | Not Available |
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Chemical Formula: | C31H44O2 |
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Weight: | Average: 448.6799 Monoisotopic: 448.334130652 |
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InChI Key: | SUEXOUCDLKXLBJ-CLANZHPSSA-N |
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InChI: | InChI=1S/C31H44O2/c1-23(2)11-12-24(3)13-14-25(4)15-16-26(5)17-18-27(6)19-20-28(7)21-22-29-9-8-10-30(32)31(29)33/h8-11,13,15,17,19,21,32-33H,12,14,16,18,20,22H2,1-7H3/b24-13+,25-15+,26-17+,27-19+,28-21+ |
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CAS number: | Not Available |
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IUPAC Name: | 3-[(2E,5E,8E,11E,14E)-3,6,9,12,15,18-hexamethylnonadeca-2,5,8,11,14,17-hexaen-1-yl]benzene-1,2-diol |
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Traditional IUPAC Name: | 3-[(2E,5E,8E,11E,14E)-3,6,9,12,15,18-hexamethylnonadeca-2,5,8,11,14,17-hexaen-1-yl]benzene-1,2-diol |
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SMILES: | CC(C)=CC\C(C)=C\C\C(C)=C\C\C(C)=C\C\C(C)=C\C\C(C)=C\CC1=C(O)C(O)=CC=C1 |
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Chemical Taxonomy |
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Description | belongs to the class of organic compounds known as catechols. Catechols are compounds containing a 1,2-benzenediol moiety. |
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Kingdom | Organic compounds |
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Super Class | Benzenoids |
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Class | Phenols |
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Sub Class | Benzenediols |
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Direct Parent | Catechols |
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Alternative Parents | |
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Substituents | - Catechol
- 1-hydroxy-4-unsubstituted benzenoid
- 1-hydroxy-2-unsubstituted benzenoid
- Monocyclic benzene moiety
- Organic oxygen compound
- Hydrocarbon derivative
- Organooxygen compound
- Aromatic homomonocyclic compound
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Molecular Framework | Aromatic 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: | 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 | Not Available | Kegg ID | Not Available | ChemSpider ID | Not Available | Wikipedia ID | Not Available | BioCyc ID | Not Available |
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