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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 > 1-[(1s)-1'-benzoyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-2-cyclopropylethanone
... > 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 > 1-[(1s)-1'-benzoyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-2-cyclopropylethanone
... > 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 > 1-[(1s)-1'-benzoyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-2-cyclopropylethanone
... > 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 > 1-[(1s)-1'-benzoyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-2-cyclopropylethanone
... > 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 > 1-[(1s)-1'-benzoyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-2-cyclopropylethanone
... > 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 > 1-[(1s)-1'-benzoyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-2-cyclopropylethanone
... > 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 > 1-[(1s)-1'-benzoyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-2-cyclopropylethanone
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > pyridoindole > beta-carbolines > harmala alkaloid > 1-[(1s)-1'-benzoyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-2-cyclopropylethanone
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > pyridoindole > beta-carbolines > harmala alkaloid > 1-[(1s)-1'-benzoyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-2-cyclopropylethanone

Preferred term

1-[(1s)-1'-benzoyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1h-pyrido[3,4-b]indole-4,3'-azetidine]yl]-2-cyclopropylethanone  

Type

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

Broader concept

charge

  • 0

formula

  • C27H29N3O4

inchi

  • InChI=1S/C27H29N3O4/c1-34-19-9-10-20-21(12-19)28-25-22(13-31)30(23(32)11-17-7-8-17)16-27(24(20)25)14-29(15-27)26(33)18-5-3-2-4-6-18/h2-6,9-10,12,17,22,28,31H,7-8,11,13-16H2,1H3/t22-/m1/s1

inchikey

  • ZGXNZUXYZONEJW-JOCHJYFZSA-N

mass

  • 459.538

monoisotopicmass

  • 459.21581

smiles

  • COC1=CC2=C(C=C1)C3=C(N2)[C@H](N(CC34CN(C4)C(=O)C5=CC=CC=C5)C(=O)CC6CC6)CO

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:127118

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