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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 > (3s)-3-amino-4-(1h-indol-3-yl)butanoic acid
organooxygen compound > (3s)-3-amino-4-(1h-indol-3-yl)butanoic acid

Preferred term

(3s)-3-amino-4-(1h-indol-3-yl)butanoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C12H14N2O2

has_functional_parent

inchi

  • InChI=1S/C12H14N2O2/c13-9(6-12(15)16)5-8-7-14-11-4-2-1-3-10(8)11/h1-4,7,9,14H,5-6,13H2,(H,15,16)/t9-/m0/s1

inchikey

  • DUVVFMLAHWNDJD-VIFPVBQESA-N

mass

  • 218.256

monoisotopicmass

  • 218.10553

smiles

  • OC(=O)C[C@@H](N)CC=1C=2C(NC1)=CC=CC2

subset

  • 2_STAR

synonym EXACT

  • (3S)-3-amino-4-(1H-indol-3-yl)butanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:181197

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