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Chemistry, part 1

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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 > carboxamide > monocarboxylic acid amide > amoxicilloyl-butylamine
organooxygen compound > carboxamide > monocarboxylic acid amide > amoxicilloyl-butylamine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > monocarboxylic acid amide > amoxicilloyl-butylamine
... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > thiazolidinemonocarboxylic acid > amoxicilloyl-butylamine
... > organooxygen compound > carbon oxoacid > carboxylic acid > monocarboxylic acid > thiazolidinemonocarboxylic acid > amoxicilloyl-butylamine
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > thiazolidinemonocarboxylic acid > amoxicilloyl-butylamine
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > thiazolidinemonocarboxylic acid > amoxicilloyl-butylamine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > organosulfur heterocyclic compound > thiazolidines > thiazolidinemonocarboxylic acid > amoxicilloyl-butylamine
organic heterocyclic compound > organosulfur heterocyclic compound > thiazolidines > thiazolidinemonocarboxylic acid > amoxicilloyl-butylamine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > thiazolidines > thiazolidinemonocarboxylic acid > amoxicilloyl-butylamine
organic heterocyclic compound > organonitrogen heterocyclic compound > thiazolidines > thiazolidinemonocarboxylic acid > amoxicilloyl-butylamine
organic heterocyclic compound > organic heteromonocyclic compound > thiazolidines > thiazolidinemonocarboxylic acid > amoxicilloyl-butylamine

Preferred term

amoxicilloyl-butylamine  

Type

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

Broader concept

charge

  • 0

formula

  • C20H30N4O5S

has_functional_parent

inchi

  • InChI=1S/C20H30N4O5S/c1-4-5-10-22-17(27)14(18-24-15(19(28)29)20(2,3)30-18)23-16(26)13(21)11-6-8-12(25)9-7-11/h6-9,13-15,18,24-25H,4-5,10,21H2,1-3H3,(H,22,27)(H,23,26)(H,28,29)/t13-,14-,15+,18-/m1/s1

inchikey

  • SHISHHBVUCCUJC-ZXFNITATSA-N

is_conjugate_acid_of

mass

  • 438.54100

monoisotopicmass

  • 438.19369

smiles

  • [H][C@]1(N[C@@H](C(O)=O)C(C)(C)S1)[C@H](NC(=O)[C@H](N)c1ccc(O)cc1)C(=O)NCCCC

subset

  • 3_STAR

synonym EXACT

  • (2R,4S)-2-[(1R)-1-{[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino}-2-(butylamino)-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid

synonym RELATED

  • AX-BA
  • AXO-BA

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:55470

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