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Substance Name: beta-Casokinin 10
RN: 118060-90-5
InChIKey: QMLXCJQZMNVNMU-ABCDUJAMSA-N

Note

  • A synthetic bioactive caseinopeptide; corresponds to residues 193-202, a bioactive sequence in bovine beta-casein, with an amino acid substitution (Q/E) at position 195.

Molecular Weight

  • 1156.35
 
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Names and Synonyms

Name of Substance

  • beta-Casokinin 10

Synonyms

  • Tyr-gln-gln-pro-val-leu-gly-pro-val-arg
  • Tyrosyl-glutaminyl-glutaminyl-prolyl-valyl-leucyl-glycyl-prolyl-valyl-arginine
  • Yqqpvlgpvr

Systematic Name

  • L-Arginine, N2-(N-(1-(N-(N-(N-(1-(N2-(N2-L-tyrosyl-L-glutaminyl)-L-glutaminyl)-L-prolyl)-L-valyl)-L-leucyl)glycyl)-L-prolyl)-L-valyl)-

Registry Numbers

CAS Registry Number

  • 118060-90-5

System Generated Number

  • 0118060905

Structure Descriptors

InChI

1S/C53H85N15O14/c1-27(2)24-36(45(74)60-26-41(72)67-22-8-11-37(67)47(76)65-42(28(3)4)49(78)63-35(52(81)82)10-7-21-59-53(57)58)64-50(79)43(29(5)6)66-48(77)38-12-9-23-68(38)51(80)34(18-20-40(56)71)62-46(75)33(17-19-39(55)70)61-44(73)32(54)25-30-13-15-31(69)16-14-30/h13-16,27-29,32-38,42-43,69H,7-12,17-26,54H2,1-6H3,(H2,55,70)(H2,56,71)(H,60,74)(H,61,73)(H,62,75)(H,63,78)(H,64,79)(H,65,76)(H,66,77)(H,81,82)(H4,57,58,59)/t32-,33-,34-,35-,36-,37-,38-,42-,43-/m0/s1

InChIKey

QMLXCJQZMNVNMU-ABCDUJAMSA-N

Smiles

C([C@@H](NC([C@@H](NC([C@H]1N(CCC1)C(CNC([C@@H](NC([C@@H](NC([C@H]1N(CCC1)C([C@@H](NC([C@@H](NC([C@@H](N)Cc1ccc(O)cc1)=O)CCC(=O)N)=O)CCC(=O)N)=O)=O)C(C)C)=O)CC(C)C)=O)=O)=O)C(C)C)=O)CCCNC(=N)N)(=O)O