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Substance Name: L-Valinamide, 1-(3-phenyl-2-((N-(N-L-seryl-L-alanyl)-L-alanyl)amino)propyl)-L-prolyl-L-valyl-, (S)-
RN: 126380-78-7
InChIKey: PYMRHYWECWSZQC-SJOJMEJSSA-N

Molecular Formula

  • C33-H54-N8-O7

Molecular Weight

  • 674.8386
 
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Names and Synonyms

Synonym

  • SAA-9-VV-NH2

Systematic Name

  • L-Valinamide, 1-(3-phenyl-2-((N-(N-L-seryl-L-alanyl)-L-alanyl)amino)propyl)-L-prolyl-L-valyl-, (S)-

Registry Numbers

CAS Registry Number

  • 126380-78-7

System Generated Number

  • 0126380787

Structure Descriptors

InChI

1S/C33H54N8O7/c1-18(2)26(28(35)43)39-33(48)27(19(3)4)40-32(47)25-13-10-14-41(25)16-23(15-22-11-8-7-9-12-22)38-30(45)21(6)36-29(44)20(5)37-31(46)24(34)17-42/h7-9,11-12,18-21,23-27,42H,10,13-17,34H2,1-6H3,(H2,35,43)(H,36,44)(H,37,46)(H,38,45)(H,39,48)(H,40,47)/t20-,21-,23-,24-,25-,26-,27-/m0/s1

InChIKey

PYMRHYWECWSZQC-SJOJMEJSSA-N

Smiles

C[C@@H](C(=O)N[C@@H](Cc1ccccc1)CN2CCC[C@H]2C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)N