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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)-1'-ethylsulfonyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-(4-fluorophenyl)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)-1'-ethylsulfonyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-(4-fluorophenyl)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)-1'-ethylsulfonyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-(4-fluorophenyl)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)-1'-ethylsulfonyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-(4-fluorophenyl)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)-1'-ethylsulfonyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-(4-fluorophenyl)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)-1'-ethylsulfonyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-(4-fluorophenyl)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)-1'-ethylsulfonyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-(4-fluorophenyl)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)-1'-ethylsulfonyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-(4-fluorophenyl)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)-1'-ethylsulfonyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-(4-fluorophenyl)methanone

Preferred term

[(1r)-1'-ethylsulfonyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-(4-fluorophenyl)methanone  

Type

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

Broader concept

charge

  • 0

formula

  • C24H26FN3O5S

inchi

  • InChI=1S/C24H26FN3O5S/c1-3-34(31,32)27-12-24(13-27)14-28(23(30)15-4-6-16(25)7-5-15)20(11-29)22-21(24)18-9-8-17(33-2)10-19(18)26-22/h4-10,20,26,29H,3,11-14H2,1-2H3/t20-/m0/s1

inchikey

  • NSLDSLPHAKJPDW-FQEVSTJZSA-N

mass

  • 487.546

monoisotopicmass

  • 487.15772

smiles

  • CCS(=O)(=O)N1CC2(C1)CN([C@H](C3=C2C4=C(N3)C=C(C=C4)OC)CO)C(=O)C5=CC=C(C=C5)F

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:126589

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