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Concept information

Preferred term

enalkiren  

Type

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

Broader concept

charge

  • 0

formula

  • C35H56N6O6

inchi

  • InChI=1S/C35H56N6O6/c1-22(2)15-30(42)32(44)27(16-23-9-7-6-8-10-23)40-34(46)29(18-25-20-37-21-38-25)41-33(45)28(39-31(43)19-35(3,4)36)17-24-11-13-26(47-5)14-12-24/h11-14,20-23,27-30,32,42,44H,6-10,15-19,36H2,1-5H3,(H,37,38)(H,39,43)(H,40,46)(H,41,45)/t27-,28-,29-,30-,32+/m0/s1

inchikey

  • KQXVERRYBYGQJZ-WRPDIKACSA-N

mass

  • 656.857

monoisotopicmass

  • 656.42613

smiles

  • COc1ccc(C[C@H](NC(=O)CC(C)(C)N)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)[C@@H](O)CC(C)C)cc1

subset

  • 2_STAR

synonym EXACT

  • Enalkiren

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:4787

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