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Chemistry, part 2

Content language

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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 > organonitrogen heterocyclic compound > benzodiazepine > 9-deoxy tilivalline
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > benzodiazepine > 9-deoxy tilivalline
... > 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 > benzodiazepine > 9-deoxy tilivalline
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > benzodiazepine > 9-deoxy tilivalline
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzodiazepine > 9-deoxy tilivalline
... > 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 > organic heteropolycyclic compound > benzodiazepine > 9-deoxy tilivalline
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzodiazepine > 9-deoxy tilivalline

Preferred term

9-deoxy tilivalline  

Type

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

Broader concept

charge

  • 0

formula

  • C20H19N3O

inchi

  • InChI=1S/C20H19N3O/c24-20-14-7-2-4-9-17(14)22-19(18-10-5-11-23(18)20)15-12-21-16-8-3-1-6-13(15)16/h1-4,6-9,12,18-19,21-22H,5,10-11H2/t18-,19-/m0/s1

inchikey

  • CAWZYUQNVABYFN-OALUTQOASA-N

mass

  • 317.392

monoisotopicmass

  • 317.15281

smiles

  • O=C1N2[C@H]([C@H](C=3C4=C(C=CC=C4)NC3)NC5=C1C=CC=C5)CCC2

subset

  • 2_STAR

synonym EXACT

  • (6S,6aS)-6-(1H-indol-3-yl)-5,6,6a,7,8,9-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:219985

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