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 | PAMDB110772 |
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Identification |
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Name: |
3-(all-trans-octaprenyl)benzene-1,2-diol |
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Description: | A 3-(all-trans-polyprenyl)benzene-1,2-diol in which the substituent at position 3 is an all-trans-octaprenyl moiety. |
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Structure |
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Synonyms: | -
2-octaprenyl-6-hydroxyphenol
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Chemical Formula: |
C46H70O2
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Average Molecular Weight: |
655.06 |
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Monoisotopic Molecular
Weight: |
654.5375814912 |
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InChI Key: |
YNPGYMZVNLIZLD-BQFKTQOQSA-N |
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InChI: |
InChI=1S/C46H70O2/c1-36(2)18-10-19-37(3)20-11-21-38(4)22-12-23-39(5)24-13-25-40(6)26-14-27-41(7)28-15-29-42(8)30-16-31-43(9)34-35-44-32-17-33-45(47)46(44)48/h17-18,20,22,24,26,28,30,32-34,47-48H,10-16,19,21,23,25,27,29,31,35H2,1-9H3/b37-20+,38-22+,39-24+,40-26+,41-28+,42-30+,43-34+ |
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CAS
number: |
Not Available |
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IUPAC Name: | 3-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl]benzene-1,2-diol |
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Traditional IUPAC Name: |
Not Available |
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SMILES: | CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCC1(C(O)=C(O)C=CC=1))C)C)C)C)C)C)C)C |
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Chemical Taxonomy |
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Taxonomy Description | This compound belongs to the class of organic compounds known as polyprenylbenzene-1,2-diols. These are compounds containing a polyisoprene chain attached to a catechol group. |
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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 | Polyprenylphenols |
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Direct Parent |
Polyprenylbenzene-1,2-diols |
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Alternative Parents |
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Substituents |
- Tetraterpenoid
- Polyprenylbenzene-1,2-diol
- Catechol
- 1-hydroxy-4-unsubstituted benzenoid
- 1-hydroxy-2-unsubstituted benzenoid
- Phenol
- 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 |
- a 3-\u003ci\u003eall-trans\u003c/i\u003e-polyrenylbenzene-1,2-diol (2-OCTAPRENYL-6-HYDROXYPHENOL)
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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: |
Not Available |
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Predicted Properties |
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Biological Properties |
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Cellular Locations: |
Not Available |
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Reactions: | |
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Pathways: |
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Spectra |
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Spectra: |
Not Available |
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References |
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References: |
- Hsu AY, Poon WW, Shepherd JA, Myles DC, Clarke CF (1996)Complementation of coq3 mutant yeast by mitochondrial targeting of the Escherichia coli UbiG polypeptide: evidence that UbiG catalyzes both O-methylation steps in ubiquinone biosynthesis. Biochemistry 35, Pubmed: 8703953
- Poon WW, Barkovich RJ, Hsu AY, Frankel A, Lee PT, Shepherd JN, Myles DC, Clarke CF (1999)Yeast and rat Coq3 and Escherichia coli UbiG polypeptides catalyze both O-methyltransferase steps in coenzyme Q biosynthesis. The Journal of biological chemistry 274, Pubmed: 10419476
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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: |
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