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Chemistry, part 3

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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 > alkaloid > epibatidine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organonitrogen compound > alkaloid > epibatidine

Preferred term

epibatidine  

Type

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

Broader concept

alt_id

  • CHEBI:47399

charge

  • 0

formula

  • C11H13ClN2

inchi

  • InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2/t8?,9-,10+/m1/s1

inchikey

  • NLPRAJRHRHZCQQ-XVBQNVSMSA-N

mass

  • 208.690

monoisotopicmass

  • 208.07673

smiles

  • C12C[C@@]([C@@H](N1)CC2)(C=3C=NC(=CC3)Cl)[H]

subset

  • 2_STAR

synonym EXACT

  • epibatidine

synonym RELATED

  • (1R,2R,4S)-2-(6-chloropyridin-3-yl)-7-azabicyclo[2.2.1]heptane
  • CMI 488
  • CMI-488

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:4803

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