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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 > carbon group molecular entity > organic molecular entity > organic amino compound > amine > amphetamines > nigerrimin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > amine > amphetamines > nigerrimin a

Preferred term

nigerrimin a  

Type

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

Broader concept

charge

  • 0

formula

  • C16H17NO4

inchi

  • InChI=1S/C16H17NO4/c18-10-13(8-11-4-2-1-3-5-11)17-16(21)12-6-7-14(19)15(20)9-12/h1-7,9,13,18-20H,8,10H2,(H,17,21)/t13-/m0/s1

inchikey

  • PJPGHPWWCHJZNR-ZDUSSCGKSA-N

mass

  • 287.315

monoisotopicmass

  • 287.11576

smiles

  • O=C(N[C@H](CO)CC1=CC=CC=C1)C2=CC(O)=C(O)C=C2

subset

  • 2_STAR

synonym EXACT

  • 3,4-dihydroxy-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214114

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