| Entry |
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| Name |
Nicotinate;
Nicotinic acid;
Niacin;
3-Pyridinecarboxylic acid
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| Formula |
C6H5NO2
|
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| Exact mass |
123.032
|
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| Mol weight |
123.1094
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| Structure |
     |
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| Remark |
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| Reaction |
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| Pathway |
| Nicotinate and nicotinamide metabolism | | Tropane, piperidine and pyridine alkaloid biosynthesis | | Biosynthesis of plant secondary metabolites | | Biosynthesis of alkaloids derived from ornithine, lysine and nicotinic acid | | Metabolic pathways | | Biosynthesis of secondary metabolites | | Pertussis |
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| Enzyme |
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| Brite |
Compounds with biological roles [BR:br08001]
Cofactors
Vitamins
Water-soluble vitamins
C00253 Nicotinic acid (Vitamin B3)
Phytochemical compounds [BR:br08003]
Alkaloids
Alkaloids derived from nicotinic acid
Pyridine alkaloids
C00253 Nicotinate
 |
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| Other DBs |
CAS: 59-67-6 PubChem: ChEBI: KNApSAcK: PDB-CCD: 3DMET: NIKKAJI: |
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| KCF data |
ATOM 9
1 C8y C 25.1352 -16.9986
2 C8x C 23.9013 -16.3004
3 C8x C 25.1469 -18.3372
4 C6a C 26.3341 -16.2944
5 C8x C 22.6849 -17.0102
6 N5x N 23.9013 -19.1114
7 O6a O 27.5389 -16.9812
8 O6a O 26.3108 -14.9035
9 C8x C 22.6908 -18.4130
BOND 9
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 3 6 1
6 4 7 1
7 4 8 2
8 5 9 1
9 6 9 2
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