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Substance Name: SYN 1390
RN: 217199-33-2
InChIKey: ITFISDXCIFJSNX-FKDJIAHXSA-M

Classification Code

  • Human Leukocyte Elastase Inhibitors

Molecular Formula

  • C21-H29-N3-O7-S.Na

Molecular Weight

  • 489.5222
 
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Names and Synonyms

Name of Substance

  • SYN 1390

Synonyms

  • SYN 1390
  • Syn-1390

Systematic Name

  • 1-Piperazineacetic acid, 4-(((6''R,7''S)-7''-methoxy-3''-methyl-5,'',5''-dioxido-8''-oxodispiro(cyclopentane-1,1'-cyclopropane-2',4''-(5)thia(1)azabicyclo(4.2.0)oct(2)en)-2''-yl)carbonyl)-, sodium salt

Registry Numbers

CAS Registry Number

  • 217199-33-2

System Generated Number

  • 0217199332

Molecular Formulas

Molecular Formula

  • C21-H29-N3-O7-S.Na

Molecular Formula Fragments

  • C21-H29-N3-O7-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C21H29N3O7S.Na/c1-13-15(17(27)23-9-7-22(8-10-23)11-14(25)26)24-18(28)16(31-2)19(24)32(29,30)21(13)12-20(21)5-3-4-6-20;/h16,19H,3-12H2,1-2H3,(H,25,26);/q;+1/p-1/t16-,19+,21?;/m0./s1

InChIKey

ITFISDXCIFJSNX-FKDJIAHXSA-M

Smiles

[Na+].CO[C@@H]1[C@@H]2N(C1=O)C(=C(C)C3(CC34CCCC4)S2(=O)=O)C(=O)N5CCN(CC(=O)[O-])CC5