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Chemistry, part 3

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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 > alkaloid > isoquinoline alkaloid > benzylisoquinoline alkaloid > aporphine alkaloid > isoboldine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organonitrogen compound > alkaloid > isoquinoline alkaloid > benzylisoquinoline alkaloid > aporphine alkaloid > isoboldine

Preferred term

isoboldine  

Type

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

Broader concept

charge

  • 0

formula

  • C19H21NO4

inchi

  • InChI=1S/C19H21NO4/c1-20-5-4-10-8-16(24-3)19(22)18-12-9-15(23-2)14(21)7-11(12)6-13(20)17(10)18/h7-9,13,21-22H,4-6H2,1-3H3/t13-/m0/s1

inchikey

  • LINHZVMHXABQLB-ZDUSSCGKSA-N

mass

  • 327.375

monoisotopicmass

  • 327.14706

smiles

  • COc1cc-2c(C[C@@H]3N(C)CCc4cc(OC)c(O)c-2c34)cc1O

subset

  • 2_STAR

synonym EXACT

  • Isoboldine

synonym RELATED

  • 2,10-Dimethoxy-6aalpha-aporphine-1,9-diol
  • 6aalpha-Aporphine-1,9-diol, 2,10-dimethoxy-
  • (+)-Isoboldine

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:5986

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