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Substance Name: tert-Butyloxycarbonyl-valyl-(benzyl)seryl-glutaminyl-asparaginyl-(brz)tyrosyl-proline
RN: 138865-77-7
InChIKey: NOSLNGMGLUZOKG-CNKJTFKXSA-N

Molecular Formula

  • C51-H65-Br-N8-O15

Molecular Weight

  • 1110.02
 
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Names and Synonyms

Name of Substance

  • tert-Butyloxycarbonyl-valyl-(benzyl)seryl-glutaminyl-asparaginyl-(brz)tyrosyl-proline

Synonyms

  • Boc-bgat-prooh
  • Boc-val-ser(bzl)-gln-asn-tyr(brz)-pro-OH
  • Boc-valyl-benzylseryl-glutaminyl-asparaginyl-(brz)tyrosyl-proline

Systematic Name

  • L-Proline, 1-(O-(((4-bromophenyl)methoxy)carbonyl)-N-(N2-(N2-(N-(N-((1,1-dimethylethoxy)carbonyl)-L-valyl)-O-(phenylmethyl)-L-seryl)-L-glutaminyl)-L-asparaginyl)-L-tyrosyl)-

Registry Numbers

CAS Registry Number

  • 138865-77-7

System Generated Number

  • 0138865777

Structure Descriptors

InChI

1S/C51H65BrN8O15/c1-29(2)25-73-50(70)59-43(30(3)4)47(66)58-39(28-72-26-32-9-6-5-7-10-32)46(65)55-36(20-21-41(53)61)44(63)56-37(24-42(54)62)45(64)57-38(48(67)60-22-8-11-40(60)49(68)69)23-31-14-18-35(19-15-31)75-51(71)74-27-33-12-16-34(52)17-13-33/h5-7,9-10,12-19,29-30,36-40,43H,8,11,20-28H2,1-4H3,(H2,53,61)(H2,54,62)(H,55,65)(H,56,63)(H,57,64)(H,58,66)(H,59,70)(H,68,69)/t36-,37-,38-,39-,40-,43-/m0/s1

InChIKey

NOSLNGMGLUZOKG-CNKJTFKXSA-N

Smiles

c1(ccc(cc1)Br)COC(Oc1ccc(cc1)C[C@H](NC([C@@H](NC([C@@H](NC([C@H](COCc1ccccc1)NC([C@H](C(C)C)NC(OCC(C)C)=O)=O)=O)CCC(N)=O)=O)CC(N)=O)=O)C(N1[C@@H](CCC1)C(O)=O)=O)=O