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Substance Name: Asterin
RN: 148057-23-2
InChIKey: MUWSKAXEQCKXQN-KJRKMCEKSA-N

Note

  • From root of Aster tataricus.

Molecular Weight

  • 570.471
 
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Names and Synonyms

Results Name

  • Asterin

Synonyms

  • Asterin (peptide)
  • Astin C

Systematic Name

  • Cyclo((R)-3-phenyl-beta-alanyl-L-2-aminobutanoyl-(2alpha,3alpha,4alpha)-3,4-dichloro-L-prolyl-L-2-aminobutanoyl-L-seryl)

Registry Numbers

CAS Registry Number

  • 148057-23-2

System Generated Number

  • 0148057232

Structure Descriptors

InChI

1S/C25H33Cl2N5O6/c1-3-16(29)21(35)25(12-33,22(36)20(34)14(10-28)13-8-6-5-7-9-13)32(23(37)17(30)4-2)24(38)19-18(27)15(26)11-31-19/h5-10,12,14-19,22,28,31,36H,3-4,11,29-30H2,1-2H3/t14?,15-,16?,17?,18?,19+,22-,25+/m1/s1

InChIKey

MUWSKAXEQCKXQN-KJRKMCEKSA-N

Smiles

C([C@@](N(C([C@@H](CC)N)=O)C([C@H]1NC[C@H]([C@@H]1Cl)Cl)=O)([C@H](O)C([C@@H](C=N)c1ccccc1)=O)C([C@@H](CC)N)=O)=O