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Chemistry, part 2

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 > organonitrogen heterocyclic compound > azabicycloalkane > tropane alkaloid > schizanthine n
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > azabicycloalkane > tropane alkaloid > schizanthine n
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > azabicycloalkane > tropane alkaloid > schizanthine n
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > azabicycloalkane > tropane alkaloid > schizanthine n
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > azabicycloalkane > tropane alkaloid > schizanthine n
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > azabicycloalkane > tropane alkaloid > schizanthine n
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > azabicycloalkane > tropane alkaloid > schizanthine n
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > alkaloid > tropane alkaloid > schizanthine n

Preferred term

schizanthine n  

Type

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

Broader concept

charge

  • 0

formula

  • C18H27NO5

has_role

inchi

  • InChI=1S/C18H27NO5/c1-5-12(3)18(22)24-16-8-13-7-14(9-15(16)19(13)4)23-17(21)6-11(2)10-20/h5-6,13-16,20H,7-10H2,1-4H3/b11-6+,12-5-/t13-,14+,15+,16+/m0/s1

inchikey

  • BQBJPUJMIOEUKT-MJVHBNRGSA-N

mass

  • 337.41070

monoisotopicmass

  • 337.18892

smiles

  • [H][C@]12C[C@H](C[C@]([H])([C@@H](C1)OC(=O)C(/C)=C/C)N2C)OC(=O)/C=C(/C)CO

subset

  • 2_STAR

synonym RELATED

  • 3alpha-(E)-4-hydroxysenecioyloxy-6beta-angeloyloxytropane

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:70106

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