skip to main content

Chemistry, part 1

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > tertiary amino compound > tertiary amine > difenoxin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > tertiary amino compound > tertiary amine > difenoxin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > amine > tertiary amine > difenoxin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > amine > tertiary amine > difenoxin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > cyanides > nitrile > difenoxin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > piperidines > piperidinemonocarboxylic acid > difenoxin
organic heterocyclic compound > organonitrogen heterocyclic compound > piperidines > piperidinemonocarboxylic acid > difenoxin
organic heterocyclic compound > organic heteromonocyclic compound > piperidines > piperidinemonocarboxylic acid > difenoxin
... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > piperidinemonocarboxylic acid > difenoxin
... > organooxygen compound > carbon oxoacid > carboxylic acid > monocarboxylic acid > piperidinemonocarboxylic acid > difenoxin
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > piperidinemonocarboxylic acid > difenoxin
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > piperidinemonocarboxylic acid > difenoxin

Preferred term

difenoxin  

Type

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

Broader concept

charge

  • 0

formula

  • C28H28N2O2

has_role

inchi

  • InChI=1S/C28H28N2O2/c29-22-28(24-12-6-2-7-13-24,25-14-8-3-9-15-25)18-21-30-19-16-27(17-20-30,26(31)32)23-10-4-1-5-11-23/h1-15H,16-21H2,(H,31,32)

inchikey

  • UFIVBRCCIRTJTN-UHFFFAOYSA-N

mass

  • 424.53410

monoisotopicmass

  • 424.21508

smiles

  • OC(=O)C1(CCN(CC1)CCC(C#N)(c1ccccc1)c1ccccc1)c1ccccc1

subset

  • 3_STAR

synonym EXACT

  • 1-(3-cyano-3,3-diphenylpropyl)-4-phenylpiperidine-4-carboxylic acid
  • Difenoxin

synonym RELATED

  • 1-(3-cyano-3,3-diphenylpropyl)-4-phenylisonipecotic acid
  • difenoxin
  • difenoxina
  • difenoxinum
  • diphenoxilic acid
  • diphenoxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:4534

Download this concept:

RDF/XML TURTLE JSON-LD