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 | PAMDB110353 |
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Identification |
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Name: |
5-methyl-phenazine-1-carboxylate |
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Description: | An iminium betaine consisting of phenazine carrying carboxylate- and methyl substituents at positions 1 and 5 respectively. |
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Structure |
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Synonyms: | -
5-methyl-phenazine-1-carboxylic acid
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Chemical Formula: |
C14H10N2O2
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Average Molecular Weight: |
239.0820526077 |
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Monoisotopic Molecular
Weight: |
239.0820526077 |
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InChI Key: |
WBQUROCKWAJPFB-UHFFFAOYSA-N |
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InChI: |
InChI=1S/C14H10N2O2/c1-16-11-7-3-2-6-10(11)15-13-9(14(17)18)5-4-8-12(13)16/h2-8H,1H3 |
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CAS
number: |
Not Available |
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IUPAC Name: | 5-methylphenazin-5-ium-1-carboxylate |
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Traditional IUPAC Name: |
Not Available |
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SMILES: | C[N+]1(=C3(C=CC=C(C(=NC2(C=CC=CC1=2))3)C(=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 phenazines and derivatives. These are polycyclic aromatic compounds containing a phenazine moiety, which is a linear tricyclic system that consists of a two benzene rings joined by a pyrazine ring. |
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Kingdom |
Organic compounds |
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Super Class | Organoheterocyclic compounds |
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Class |
Diazanaphthalenes |
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Sub Class | Benzodiazines |
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Direct Parent |
Phenazines and derivatives |
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Alternative Parents |
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Substituents |
- Phenazine
- Pyrazine
- Pyrazinium
- Benzenoid
- Heteroaromatic compound
- Carboxylic acid salt
- Azacycle
- Monocarboxylic acid or derivatives
- Carboxylic acid
- Carboxylic acid derivative
- Organic salt
- Organic oxide
- Organopnictogen compound
- Organic oxygen compound
- Organic nitrogen compound
- Organooxygen compound
- Organonitrogen compound
- Hydrocarbon derivative
- Aromatic heteropolycyclic compound
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Molecular Framework |
Aromatic heteropolycyclic compounds |
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External Descriptors |
- iminium betaine, phenazine (CHEBI:62221)
- a secondary metabolite (CPD-12869)
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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: |
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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