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Chemistry, part 1

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > benzoate ester > (3s,4r)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid
organooxygen compound > carbonyl compound > carboxylic ester > benzoate ester > (3s,4r)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid

Preferred term

(3s,4r)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C16H19NO4

inchi

  • InChI=1S/C16H19NO4/c1-17-11-7-8-12(17)14(15(18)19)13(9-11)21-16(20)10-5-3-2-4-6-10/h2-6,11-14H,7-9H2,1H3,(H,18,19)/t11?,12?,13-,14+/m0/s1

inchikey

  • GVGYEFKIHJTNQZ-CLRIEMFWSA-N

mass

  • 289.331

monoisotopicmass

  • 289.13141

smiles

  • O([C@@H]1[C@@H](C2N(C(CC2)C1)C)C(O)=O)C(=O)C3=CC=CC=C3

subset

  • 2_STAR

synonym EXACT

  • (2R,3S)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:181959

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