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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 | PAMDB110778 |
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Identification |
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| Name: |
pyridoxine 5'-phosphate |
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| Description: | Dianion of pyridoxine 5'-phosphate. |
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Structure |
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| Synonyms: | -
pyridoxol 5'-phosphate
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pyridoxine 5-phosphate
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pyridoxine phosphate
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pyridoxine-5P
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pyridoxine-P
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[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyl phosphate
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Chemical Formula: |
C8H10NO6P
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| Average Molecular Weight: |
247.14 |
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| Monoisotopic Molecular
Weight: |
249.040223633 |
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| InChI Key: |
WHOMFKWHIQZTHY-UHFFFAOYSA-L |
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| InChI: |
InChI=1S/C8H12NO6P/c1-5-8(11)7(3-10)6(2-9-5)4-15-16(12,13)14/h2,10-11H,3-4H2,1H3,(H2,12,13,14)/p-2 |
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| CAS
number: |
447-05-2 |
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| IUPAC Name: | [5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyl phosphate |
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Traditional IUPAC Name: |
pyridoxine-5'-phosphate |
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| SMILES: | CC1(=NC=C(COP([O-])(=O)[O-])C(=C(O)1)CO) |
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Chemical Taxonomy |
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Taxonomy Description | This compound belongs to the class of chemical entities known as pyridoxine-5'-phosphates. These are pyridoxines that carry a phosphate group at the 5-position. |
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Kingdom |
Chemical entities |
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| Super Class | Organic compounds |
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Class |
Organoheterocyclic compounds |
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| Sub Class | Pyridines and derivatives |
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Direct Parent |
Pyridoxine-5'-phosphates |
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| Alternative Parents |
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| Substituents |
- Pyridoxine-5'-phosphate
- Monoalkyl phosphate
- Hydroxypyridine
- Methylpyridine
- Organic phosphoric acid derivative
- Alkyl phosphate
- Phosphoric acid ester
- Heteroaromatic compound
- Azacycle
- Hydrocarbon derivative
- Alcohol
- Aromatic alcohol
- Organic nitrogen compound
- Primary alcohol
- Organooxygen compound
- Organonitrogen compound
- Organic oxide
- Organopnictogen compound
- Organic oxygen compound
- Aromatic heteromonocyclic compound
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| Molecular Framework |
Aromatic heteromonocyclic compounds |
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| External Descriptors |
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Physical Properties |
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| State: |
Solid |
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| Charge: | -2 |
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Melting point: |
Not Available |
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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 |
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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: |
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References |
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| References: |
Not Available |
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| Synthesis Reference: |
Argoudelis, Chris J. Preparation of crystalline pyridoxine 5'-phosphate and some of its properties. Journal of Agricultural and Food Chemistry (1986), 34(6), 995-8. |
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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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