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Substance Name: L-Phenylalanine, N-(N-(N-(N,O-bis(1,1-dimethylethoxy)carbonyl)-L-tyrosyl)-D-alanylglycyl)-
RN: 145594-19-0
InChIKey: JXWNQJZNDGYPAD-YNJKOYDBSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C33-H44-N4-O10

Molecular Weight

  • 656.7286
 
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Names and Synonyms

Synonyms

  • N-(N-(N-(N,O-Bis(1,1-dimethylethoxy)carbonyl)-L-tyrosyl)-D-alanylglycyl)-L-phenylalanine
  • N-tert-Butoxycarbonyltyrosyl-(O-tert-butoxycarbonyl)-D-alanylglycylphenylalanine

Systematic Name

  • L-Phenylalanine, N-(N-(N-(N,O-bis(1,1-dimethylethoxy)carbonyl)-L-tyrosyl)-D-alanylglycyl)-

Registry Numbers

CAS Registry Number

  • 145594-19-0

System Generated Number

  • 0145594190

Structure Descriptors

InChI

1S/C33H44N4O10/c1-20(27(39)34-19-26(38)36-25(29(41)42)18-21-11-9-8-10-12-21)35-28(40)24(37-30(43)46-32(2,3)4)17-22-13-15-23(16-14-22)45-31(44)47-33(5,6)7/h8-16,20,24-25H,17-19H2,1-7H3,(H,34,39)(H,35,40)(H,36,38)(H,37,43)(H,41,42)/t20-,24+,25+/m1/s1

InChIKey

JXWNQJZNDGYPAD-YNJKOYDBSA-N

Smiles

C[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@H](Cc2ccc(cc2)OC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 500mg/kg (500mg/kg)   Pharmaceutical Chemistry Journal Vol. 26, Pg. 446, 1992.