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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > o-desmethylverapamil (d-702)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > o-desmethylverapamil (d-702)

Preferred term

o-desmethylverapamil (d-702)  

Type

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

Broader concept

charge

  • 0

formula

  • C26H36N2O4

inchi

  • InChI=1S/C26H36N2O4/c1-19(2)26(18-27,21-9-11-24(31-5)25(17-21)32-6)13-7-14-28(3)15-12-20-8-10-23(30-4)22(29)16-20/h8-11,16-17,19,29H,7,12-15H2,1-6H3

inchikey

  • OAAPYTCHFIIVON-UHFFFAOYSA-N

mass

  • 440.584

monoisotopicmass

  • 440.26751

smiles

  • O(C=1C=C(C(C(C)C)(CCCN(CCC2=CC(O)=C(OC)C=C2)C)C#N)C=CC1OC)C

subset

  • 2_STAR

synonym EXACT

  • 2-(3,4-dimethoxyphenyl)-5-[2-(3-hydroxy-4-methoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:175551

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