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Substance Name: Hydroxypepstatin
RN: 52329-53-0
InChIKey: RDGABBULIYLDER-NWCZBACYSA-N

Molecular Formula

  • C34-H63-N5-O10

Molecular Weight

  • 701.8967
 
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Names and Synonyms

Name of Substance

  • Hydroxypepstatin

Systematic Name

  • L-Valinamide, N-(3-methyl-1-oxobutyl)-L-valyl-N-(4-((2-((1-(2-carboxy-1-hydroxyethyl)-3-methylbutyl)amino)-1-(hydroxymethyl)-2-oxoethyl)amino)-2-hydroxy-1-(2-methylpropyl)-4-oxobutyl)-, (1S-(1R*,2R*,4(R*(R*(R*)))))-

Registry Numbers

CAS Registry Number

  • 52329-53-0

System Generated Number

  • 0052329530

Structure Descriptors

InChI

1S/C34H63N5O10/c1-17(2)10-22(37-32(33(35)48)21(9)13-27(43)31(20(7)8)39-28(44)12-19(5)6)25(41)14-29(45)36-24(16-40)34(49)38-23(11-18(3)4)26(42)15-30(46)47/h17-26,31-32,37,40-42H,10-16H2,1-9H3,(H2,35,48)(H,36,45)(H,38,49)(H,39,44)(H,46,47)/t21?,22-,23?,24-,25-,26-,31-,32-/m0/s1

InChIKey

RDGABBULIYLDER-NWCZBACYSA-N

Smiles

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