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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 > harmala alkaloid > [(1r)-2-[(3,5-dimethoxyphenyl)methyl]-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,4'-piperidine]yl]-(3-pyridinyl)methanone
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > organic tricyclic compound > organic heterotricyclic compound > pyridoindole > beta-carbolines > harmala alkaloid > [(1r)-2-[(3,5-dimethoxyphenyl)methyl]-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,4'-piperidine]yl]-(3-pyridinyl)methanone
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > organic tricyclic compound > organic heterotricyclic compound > pyridoindole > beta-carbolines > harmala alkaloid > [(1r)-2-[(3,5-dimethoxyphenyl)methyl]-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,4'-piperidine]yl]-(3-pyridinyl)methanone
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > organic tricyclic compound > organic heterotricyclic compound > pyridoindole > beta-carbolines > harmala alkaloid > [(1r)-2-[(3,5-dimethoxyphenyl)methyl]-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,4'-piperidine]yl]-(3-pyridinyl)methanone
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterotricyclic compound > pyridoindole > beta-carbolines > harmala alkaloid > [(1r)-2-[(3,5-dimethoxyphenyl)methyl]-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,4'-piperidine]yl]-(3-pyridinyl)methanone
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterotricyclic compound > pyridoindole > beta-carbolines > harmala alkaloid > [(1r)-2-[(3,5-dimethoxyphenyl)methyl]-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,4'-piperidine]yl]-(3-pyridinyl)methanone
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > pyridoindole > beta-carbolines > harmala alkaloid > [(1r)-2-[(3,5-dimethoxyphenyl)methyl]-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,4'-piperidine]yl]-(3-pyridinyl)methanone
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > pyridoindole > beta-carbolines > harmala alkaloid > [(1r)-2-[(3,5-dimethoxyphenyl)methyl]-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,4'-piperidine]yl]-(3-pyridinyl)methanone
... > 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 > pyridoindole > beta-carbolines > harmala alkaloid > [(1r)-2-[(3,5-dimethoxyphenyl)methyl]-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,4'-piperidine]yl]-(3-pyridinyl)methanone
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > pyridoindole > beta-carbolines > harmala alkaloid > [(1r)-2-[(3,5-dimethoxyphenyl)methyl]-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,4'-piperidine]yl]-(3-pyridinyl)methanone

Preferred term

[(1r)-2-[(3,5-dimethoxyphenyl)methyl]-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,4'-piperidine]yl]-(3-pyridinyl)methanone  

Type

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

Broader concept

charge

  • 0

formula

  • C32H36N4O5

inchi

  • InChI=1S/C32H36N4O5/c1-39-23-6-7-26-27(16-23)34-30-28(19-37)36(18-21-13-24(40-2)15-25(14-21)41-3)20-32(29(26)30)8-11-35(12-9-32)31(38)22-5-4-10-33-17-22/h4-7,10,13-17,28,34,37H,8-9,11-12,18-20H2,1-3H3/t28-/m0/s1

inchikey

  • ZQRBUDCDWAFAJY-NDEPHWFRSA-N

mass

  • 556.653

monoisotopicmass

  • 556.26857

smiles

  • COC1=CC2=C(C=C1)C3=C(N2)[C@@H](N(CC34CCN(CC4)C(=O)C5=CN=CC=C5)CC6=CC(=CC(=C6)OC)OC)CO

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:127836

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