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Chemistry, part 1

Content language

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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 > amino-acid derivative > phenylalanine derivative > alpha-(acetylamino)-4-(3-methyl-2-butenyloxy)benzenepropanoic acid

Preferred term

alpha-(acetylamino)-4-(3-methyl-2-butenyloxy)benzenepropanoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C16H21NO4

inchi

  • InChI=1S/C16H21NO4/c1-11(2)8-9-21-14-6-4-13(5-7-14)10-15(16(19)20)17-12(3)18/h4-8,15H,9-10H2,1-3H3,(H,17,18)(H,19,20)/t15-/m0/s1

inchikey

  • YHKFAYFIUKFOFG-HNNXBMFYSA-N

mass

  • 291.347

monoisotopicmass

  • 291.14706

smiles

  • O=C(O)[C@@H](NC(=O)C)CC1=CC=C(OCC=C(C)C)C=C1

subset

  • 2_STAR

synonym EXACT

  • 2-acetamido-3-[4-(3-methylbut-2-enoxy)phenyl]propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:197549

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