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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > ammonium ion derivative > atropinium

Preferred term

atropinium  

Type

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

Broader concept

charge

  • +1

formula

  • C17H24NO3

has_role

inchi

  • InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/p+1/t13-,14+,15+,16?

inchikey

  • RKUNBYITZUJHSG-SPUOUPEWSA-O

is_conjugate_acid_of

mass

  • 290.37740

monoisotopicmass

  • 290.17507

smiles

  • C[NH+]1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)c1ccccc1

subset

  • 3_STAR

synonym EXACT

  • (3-endo,8-syn)-3-[(3-hydroxy-2-phenylpropanoyl)oxy]-8-methyl-8-azoniabicyclo[3.2.1]octane

synonym RELATED

  • atropine
  • atropinium(1+)
  • atropinium cation

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:57858

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