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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

n-[(2r,3r,6s)-6-[2-(3,4-dihydro-1h-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]-4-methylbenzenesulfonamide  

Type

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

Broader concept

charge

  • 0

formula

  • C24H30N2O5S

inchi

  • InChI=1S/C24H30N2O5S/c1-17-6-9-21(10-7-17)32(29,30)25-22-11-8-20(31-23(22)16-27)14-24(28)26-13-12-18-4-2-3-5-19(18)15-26/h2-7,9-10,20,22-23,25,27H,8,11-16H2,1H3/t20-,22+,23-/m0/s1

inchikey

  • YSHLOQAWMNLOEI-WWNPGLIZSA-N

mass

  • 458.572

monoisotopicmass

  • 458.18754

smiles

  • CC1=CC=C(C=C1)S(=O)(=O)N[C@@H]2CC[C@H](O[C@H]2CO)CC(=O)N3CCC4=CC=CC=C4C3

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:97351

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