Record Information |
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Version |
1.0 |
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Update Date |
1/22/2018 12:54:54 PM |
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Metabolite ID | PAMDB110408 |
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Identification |
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Name: |
(R)-4-hydroxymandelate |
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Description: | Not Available |
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Structure |
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Synonyms: | -
D-p-hydroxymandelate
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D-4-hydroxymandelate
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Chemical Formula: |
C8H7O4
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Average Molecular Weight: |
167.14 |
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Monoisotopic Molecular
Weight: |
168.0422587452 |
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InChI Key: |
YHXHKYRQLYQUIH-SSDOTTSWSA-M |
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InChI: |
InChI=1S/C8H8O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,7,9-10H,(H,11,12)/p-1/t7-/m1/s1 |
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CAS
number: |
Not Available |
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IUPAC Name: | (2R)-hydroxy(4-hydroxyphenyl)acetate |
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Traditional IUPAC Name: |
Not Available |
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SMILES: | C([O-])(=O)C(C1(=CC=C(C=C1)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 1-hydroxy-2-unsubstituted benzenoids. These are phenols that a unsubstituted at the 2-position. |
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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 | 1-hydroxy-2-unsubstituted benzenoids |
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Direct Parent |
1-hydroxy-2-unsubstituted benzenoids |
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Alternative Parents |
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Substituents |
- 1-hydroxy-2-unsubstituted benzenoid
- Monocyclic benzene moiety
- Secondary alcohol
- Monocarboxylic acid or derivatives
- Carboxylic acid
- Carboxylic acid derivative
- Organic oxygen compound
- Organic oxide
- Hydrocarbon derivative
- Aromatic alcohol
- Organooxygen compound
- Carbonyl group
- Alcohol
- Organic anion
- Aromatic homomonocyclic compound
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Molecular Framework |
Aromatic homomonocyclic compounds |
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External Descriptors |
- 2-hydroxy carboxylate, phenols (CHEBI:32804)
- a small molecule (CPD-106)
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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: |
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: |
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: |
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