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Concept information

Preferred term

calligonine  

Type

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

Broader concept

charge

  • 0

formula

  • C12H14N2

inchi

  • InChI=1S/C12H14N2/c1-8-12-10(6-7-13-8)9-4-2-3-5-11(9)14-12/h2-5,8,13-14H,6-7H2,1H3/t8-/m1/s1

inchikey

  • LPIJOZBIVDCQTE-MRVPVSSYSA-N

mass

  • 186.253

monoisotopicmass

  • 186.11570

smiles

  • C[C@H]1NCCc2c1[nH]c1ccccc21

subset

  • 2_STAR

synonym EXACT

  • Calligonine

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:3323

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