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Substance Name: Cysteinyl-glutamyl-asparaginyl-prolyl-serinyl-glutaminyl-phenylalanyl-tyrosyl-glutamyl-aspartyl-leucine
RN: 98813-21-9
InChIKey: MDQPSSUMVBOZPB-OEAGQSEASA-N

Molecular Formula

  • C58-H81-N13-O22-S

Molecular Weight

  • 1344.41
 
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Names and Synonyms

Name of Substance

  • Cysteinyl-glutamyl-asparaginyl-prolyl-serinyl-glutaminyl-phenylalanyl-tyrosyl-glutamyl-aspartyl-leucine

Synonyms

  • Cys-glu-asn-pro-ser-gln-phe-tyr-glu-asp-leu
  • Synthetic peptide Sp-23

Systematic Name

  • L-Leucine, N-(N-(N-(N-(N-(N2-(N-(1-(N2-(N-L-cysteinyl-L-alpha-glutamyl)-L-asparginyl)-L-prolyl)-L-seryl)-L-glutaminyl)-L-phenylalanyl)-L-tyrosyl)-L-alpha-glutamyl)-L-alpha-aspartyl)-

Registry Numbers

CAS Registry Number

  • 98813-21-9

System Generated Number

  • 0098813219

Structure Descriptors

InChI

1S/C58H81N13O22S/c1-28(2)21-35(51(85)70-41(27-94)58(92)93)64-54(88)38(25-47(80)81)67-50(84)34(16-19-46(78)79)62-52(86)37(23-30-10-12-31(73)13-11-30)66-53(87)36(22-29-7-4-3-5-8-29)65-49(83)33(15-17-43(60)74)63-55(89)40(26-72)69-56(90)42-9-6-20-71(42)57(91)39(24-44(61)75)68-48(82)32(59)14-18-45(76)77/h3-5,7-8,10-13,28,32-42,72-73,94H,6,9,14-27,59H2,1-2H3,(H2,60,74)(H2,61,75)(H,62,86)(H,63,89)(H,64,88)(H,65,83)(H,66,87)(H,67,84)(H,68,82)(H,69,90)(H,70,85)(H,76,77)(H,78,79)(H,80,81)(H,92,93)/t32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-/m0/s1

InChIKey

MDQPSSUMVBOZPB-OEAGQSEASA-N

Smiles

N[C@H](C(N[C@H](C(N1[C@H](C(=O)N[C@H](C(N[C@H](C(N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(O)=O)CS)CC(C)C)CC(=O)O)CCC(=O)O)Cc2ccc(cc2)O)Cc2ccccc2)=O)CCC(=O)N)=O)CO)CCC1)=O)CC(=O)N)=O)CCC(=O)O