skip to main content

Chemistry, part 1

Content language

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

Concept information

organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > (1s,2s,5s)-2-(4-glutaridylbenzyl)-5-phenylcyclohexan-1-ol
organooxygen compound > carbon oxoacid > carboxylic acid > monocarboxylic acid > (1s,2s,5s)-2-(4-glutaridylbenzyl)-5-phenylcyclohexan-1-ol
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > (1s,2s,5s)-2-(4-glutaridylbenzyl)-5-phenylcyclohexan-1-ol
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > (1s,2s,5s)-2-(4-glutaridylbenzyl)-5-phenylcyclohexan-1-ol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > secondary carboxamide > n-acyl-gamma-aminobutyric acid > (1s,2s,5s)-2-(4-glutaridylbenzyl)-5-phenylcyclohexan-1-ol
organooxygen compound > carboxamide > secondary carboxamide > n-acyl-gamma-aminobutyric acid > (1s,2s,5s)-2-(4-glutaridylbenzyl)-5-phenylcyclohexan-1-ol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > secondary carboxamide > n-acyl-gamma-aminobutyric acid > (1s,2s,5s)-2-(4-glutaridylbenzyl)-5-phenylcyclohexan-1-ol
... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > n-acyl-gamma-aminobutyric acid > (1s,2s,5s)-2-(4-glutaridylbenzyl)-5-phenylcyclohexan-1-ol
... > organooxygen compound > carbon oxoacid > carboxylic acid > monocarboxylic acid > n-acyl-gamma-aminobutyric acid > (1s,2s,5s)-2-(4-glutaridylbenzyl)-5-phenylcyclohexan-1-ol
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > n-acyl-gamma-aminobutyric acid > (1s,2s,5s)-2-(4-glutaridylbenzyl)-5-phenylcyclohexan-1-ol
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > n-acyl-gamma-aminobutyric acid > (1s,2s,5s)-2-(4-glutaridylbenzyl)-5-phenylcyclohexan-1-ol

Preferred term

(1s,2s,5s)-2-(4-glutaridylbenzyl)-5-phenylcyclohexan-1-ol  

Type

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

Broader concept

charge

  • 0

formula

  • C23H27NO4

has_functional_parent

has_role

inchi

  • InChI=1S/C23H27NO4/c25-21-15-19(16-5-2-1-3-6-16)12-13-20(21)17-8-10-18(11-9-17)23(28)24-14-4-7-22(26)27/h1-3,5-6,8-11,19-21,25H,4,7,12-15H2,(H,24,28)(H,26,27)/t19-,20+,21-/m0/s1

inchikey

  • OBWILOKKNDYPLX-HBMCJLEFSA-N

mass

  • 381.46480

monoisotopicmass

  • 381.19401

smiles

  • O[C@H]1C[C@H](CC[C@@H]1c1ccc(cc1)C(=O)NCCCC(O)=O)c1ccccc1

subset

  • 3_STAR

synonym EXACT

  • 4-{4-[(1R,2S,4S)-2-hydroxy-4-phenylcyclohexyl]benzamido}butanoic acid

synonym RELATED

  • (1S,2S,5S)2-(4-GLUTARIDYLBENZYL)-5-PHENYL-1-CYCLOHEXANOL
  • 4-({4-[(1R,2S,4S)-2-hydroxy-4-phenylcyclohexyl]benzoyl}amino)butanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:43278

Download this concept:

RDF/XML TURTLE JSON-LD