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Substance Name: APD-916 dicitrate
RN: 1021169-72-1
UNII: 1G739C580P
InChIKey: OHJSZGUPPGWNSH-JQDLGSOUSA-N

Molecular Formula

  • C23-H31-N-O3-S.2C6-H8-O7

Molecular Weight

  • 785.8092
 
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Names and Synonyms

Name of Substance

  • APD-916 dicitrate

Synonyms

  • APD-916 dicitrate
  • Pyrrolidine, 1-(2-(4'-((3-methoxypropyl)sulfonyl)(1,1'-biphenyl)-4-yl)ethyl)-2-methyl-, (2R)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:2)
  • UNII-1G739C580P

Registry Numbers

CAS Registry Number

  • 1021169-72-1

FDA UNII

  • 1G739C580P

System Generated Number

  • 1021169721

Structure Descriptors

InChI

1S/C23H31NO3S.2C6H8O7/c1-19-5-3-15-24(19)16-14-20-6-8-21(9-7-20)22-10-12-23(13-11-22)28(25,26)18-4-17-27-2;2*7-3(8)1-6(13,5(11)12)2-4(9)10/h6-13,19H,3-5,14-18H2,1-2H3;2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t19-;;/m1../s1

InChIKey

OHJSZGUPPGWNSH-JQDLGSOUSA-N

Smiles

COCCCS(=O)(=O)c1ccc(cc1)c2ccc(CCN3CCC[C@H]3C)cc2.OC(=O)CC(O)(CC(=O)O)C(=O)O.OC(=O)CC(O)(CC(=O)O)C(=O)O