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Substance Name: P-113D
RN: 190673-60-0
UNII: 513P3772TA
InChIKey: UIBPZXXSPHGPDS-UXLZJAPBSA-N

Note

  • A synthetic derivative of histatin 5 with potential therapeutic role in experimental rat models of Pseudomonas aeruginosa sepsis.

Molecular Weight

  • 1563.833
 
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Names and Synonyms

Name of Substance

  • P-113D

Synonyms

  • D-Peptide of the sequence akrhhgykrkfh - NH2
  • Pulmadex
  • UNII-513P3772TA

Registry Numbers

CAS Registry Number

  • 190673-60-0

FDA UNII

  • 513P3772TA

System Generated Number

  • 0190673600

Structure Descriptors

InChI

1S/C71H110N28O13/c1-41(75)60(103)91-48(15-5-8-24-72)62(105)94-52(19-12-28-85-71(79)80)66(109)99-57(33-46-36-83-40-89-46)69(112)98-56(32-45-35-82-39-88-45)61(104)86-37-58(101)90-54(30-43-20-22-47(100)23-21-43)67(110)95-49(16-6-9-25-73)63(106)93-51(18-11-27-84-70(77)78)64(107)92-50(17-7-10-26-74)65(108)97-55(29-42-13-3-2-4-14-42)68(111)96-53(59(76)102)31-44-34-81-38-87-44/h2-4,13-14,20-23,34-36,38-41,48-57,100H,5-12,15-19,24-33,37,72-75H2,1H3,(H2,76,102)(H,81,87)(H,82,88)(H,83,89)(H,86,104)(H,90,101)(H,91,103)(H,92,107)(H,93,106)(H,94,105)(H,95,110)(H,96,111)(H,97,108)(H,98,112)(H,99,109)(H4,77,78,84)(H4,79,80,85)/t41-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-/m1/s1

InChIKey

UIBPZXXSPHGPDS-UXLZJAPBSA-N

Smiles

C[C@H](C(=O)N[C@H](CCCCN)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc2cnc[nH]2)C(=O)NCC(=O)N[C@H](Cc3ccc(cc3)O)C(=O)N[C@H](CCCCN)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](CCCCN)C(=O)N[C@H](Cc4ccccc4)C(=O)N[C@H](Cc5cnc[nH]5)C(=O)N)N