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Substance Name: Butyloxycarbonyl-4-methylene-glutamyl-glutamyl-valine
RN: 95049-79-9
InChIKey: VCUNMGPIYYXXMQ-KCQAQPDRSA-N

Note

  • Inhibitor of vitamin K-dependent carboxylation.

Molecular Formula

  • C21-H33-N3-O10

Molecular Weight

  • 487.503
 
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Names and Synonyms

Name of Substance

  • Butyloxycarbonyl-4-methylene-glutamyl-glutamyl-valine

Synonyms

  • Boc-meglu-glu-val
  • N-(N-(N-((1,1-Dimethylethoxy)carbonyl)-4-methylene-L-alpha-glutamyl)-alpha-glutamyl)-L-valine

Systematic Name

  • L-Valine, N-(N-(N-((1,1-dimethylethoxy)carbonyl)-4-methylene-L-alpha-glutamyl)-alpha-glutamyl)-

Registry Numbers

CAS Registry Number

  • 95049-79-9

System Generated Number

  • 0095049799

Structure Descriptors

InChI

1S/C21H33N3O10/c1-10(2)15(19(31)32)24-16(27)12(7-8-14(25)26)22-17(28)13(9-11(3)18(29)30)23-20(33)34-21(4,5)6/h10,12-13,15H,3,7-9H2,1-2,4-6H3,(H,22,28)(H,23,33)(H,24,27)(H,25,26)(H,29,30)(H,31,32)/t12-,13-,15+/m0/s1

InChIKey

VCUNMGPIYYXXMQ-KCQAQPDRSA-N

Smiles

OC(CC[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)CC(C(O)=O)=C)C(=O)N[C@H](C(C)C)C(O)=O)=O