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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > quinolines > cj-13,564
... > 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 aromatic compound > quinolines > cj-13,564
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > quinolines > cj-13,564
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > quinolines > cj-13,564
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > quinolines > cj-13,564
... > 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 > quinolines > cj-13,564
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > quinolines > cj-13,564

Preferred term

cj-13,564  

Type

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

Broader concept

charge

  • 0

formula

  • C21H27NO2

inchi

  • InChI=1S/C21H27NO2/c1-14(11-13-19-21(3,4)24-19)10-12-17-15(2)20(23)16-8-6-7-9-18(16)22(17)5/h6-10,19H,11-13H2,1-5H3/b14-10+/t19-/m0/s1

inchikey

  • DSXHBOUOVLEJIT-ATEOEAFZSA-N

mass

  • 325.452

monoisotopicmass

  • 325.20418

smiles

  • O=C1C2=C(N(C)C(=C1C)C/C=C(/CC[C@@H]3OC3(C)C)/C)C=CC=C2

subset

  • 2_STAR

synonym EXACT

  • 2-[(E)-5-(3,3-dimethyloxiran-2-yl)-3-methylpent-2-enyl]-1,3-dimethylquinolin-4-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:216345

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