CH₃CH₃

Naldemedine

Chemistry

76 atoms · Conformer computed and published by PubChem.
Formula
C32H34N4O6
Molar mass
570.6 g/mol
IUPAC name
(4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,7,9-trihydroxy-N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-1,2,4,5,7a,13-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-6-carboxamide
InChIKey
AXQACEQYCPKDMV-RZAWKFBISA-N

Chemistry from PubChem CID 54732242.

Also known as

  • 916072-89-4
  • 03KSI6WLXH
  • naldemedina
  • S-297995
  • S-297,995
  • (4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,7,9-trihydroxy-N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-1,2,4,5,7a,13-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-6-carboxamide
  • DTXSID501030350
  • naldemedinum

Stereoisomers

2 distinct stereoisomers are registered for this structure.

  • Naldemedine this area CID 54732242
  • (4R,4aS,7aS,12bS)-3-(cyclopropylmethyl)-4a,7,9-trihydroxy-N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-1,2,4,5,7a,13-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-6-carboxamide CID 154730963
  • 3-(cyclopropylmethyl)-4a,7,9-trihydroxy-N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-1,2,4,5,7a,13-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-6-carboxamide mixture CID 71308244

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