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Substance Name: N(alpha)-3-(4-Hydroxyphenylpropionyl)asparaginyl-lysyl-(N(epsilon)-4-azidobenzoyl)threoninamide
RN: 102604-64-8
InChIKey: BRYYHCYDDZMVNH-GAVSWZITSA-N

Note

  • Active site photoaffinity probe.

Molecular Weight

  • 653.693
 
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Names and Synonyms

Name of Substance

  • N(alpha)-3-(4-Hydroxyphenylpropionyl)asparaginyl-lysyl-(N(epsilon)-4-azidobenzoyl)threoninamide

Synonym

  • N-Hpp-asp-lys-azb-thr-NH2

Registry Numbers

CAS Registry Number

  • 102604-64-8

System Generated Number

  • 0102604648

Structure Descriptors

InChI

1S/C30H39N9O8/c1-17(40)26(27(32)44)37-29(46)22(4-2-3-15-34-28(45)19-8-10-20(11-9-19)38-39-33)36-30(47)23(16-24(31)42)35-25(43)14-7-18-5-12-21(41)13-6-18/h5-6,8-13,17,22-23,26,40-41H,2-4,7,14-16H2,1H3,(H2,31,42)(H2,32,44)(H,34,45)(H,35,43)(H,36,47)(H,37,46)/t17-,22+,23+,26+/m1/s1

InChIKey

BRYYHCYDDZMVNH-GAVSWZITSA-N

Smiles

C([C@@H](NC([C@@H](NC([C@@H](NC(CCc1ccc(cc1)O)=O)CC(=O)N)=O)CCCCNC(c1ccc(cc1)N=[N+]=[N-])=O)=O)[C@@H](C)O)(=O)N