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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > pyridines > pyridinemonocarboxylic acid > isoniazid calcium pyruvate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > pyridines > pyridinemonocarboxylic acid > isoniazid calcium pyruvate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > pyridines > pyridinemonocarboxylic acid > isoniazid calcium pyruvate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > pyridines > pyridinemonocarboxylic acid > isoniazid calcium pyruvate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > pyridines > pyridinemonocarboxylic acid > isoniazid calcium pyruvate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > pyridines > pyridinemonocarboxylic acid > isoniazid calcium pyruvate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteromonocyclic compound > pyridines > pyridinemonocarboxylic acid > isoniazid calcium pyruvate
... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > pyridinemonocarboxylic acid > isoniazid calcium pyruvate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > monocarboxylic acid > pyridinemonocarboxylic acid > isoniazid calcium pyruvate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > monocarboxylic acid > pyridinemonocarboxylic acid > isoniazid calcium pyruvate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic acid > carboxylic acid > monocarboxylic acid > pyridinemonocarboxylic acid > isoniazid calcium pyruvate

Preferred term

isoniazid calcium pyruvate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • 2C9H8N3O3.Ca
  • C18H16CaN6O6

inchi

  • InChI=1S/2C9H9N3O3.Ca/c2*1-6(9(14)15)11-12-8(13)7-2-4-10-5-3-7;/h2*2-5H,1H3,(H,12,13)(H,14,15);/q;;+2/p-2/b2*11-6+;

inchikey

  • MNXSNBWJLVPGGM-HHWAHKQESA-L

mass

  • 452.435

monoisotopicmass

  • 452.07572

smiles

  • C1(=CC=NC=C1)C(N/N=C(/C([O-])=O)/C)=O.[Ca+2].C1(=CC=NC=C1)C(N/N=C(/C([O-])=O)/C)=O

subset

  • 2_STAR

synonym EXACT

  • Isoniazid calcium pyruvate

synonym RELATED

  • Pyruvic acid calcium isoniazid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:31729

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