Petogasrin

Pentagastrin A synthetic pentapeptide that has effects like gastrin when given parenterally. It stimulates the secretion of gastric acid, pepsin, and intrinsic factor, and has been used as a diagnostic aid.

Molecular Formula: C₃₇H₄₉N₇O₉S

InChI: InChI=1/C37H49N7O9S/c1-22(2)21-53-37(52)39-15-13-31(45)41-29(18-24-20-40-26-12-8-7-11-25(24)26)35(50)42-27(14-16-54-3)34(49)44-30(19-32(46)47)36(51)43-28(33(38)48)17-23-9-5-4-6-10-23/h4-12,20,22,27-30,40H,13-19,21H2,1-3H3,(H2,38,48)(H,39,52)(H,41,45)(H,42,50)(H,43,51)(H,44,49)(H,46,47)/f/h39,41-44,46H,38H2

InChIKey: InChIKey=ALXRNCVIQSDJAO-QCLDAOJJCC
SMILES: CC(C)COC(=O)NCCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CCSC)C(=O)NC(CC(=O)O)C(=O)NC(CC3=CC=CC=C3)C(=O)N

Names:
    Boc-beta-ala-try-met-asp-phe(nh2)
    EINECS 226-889-7
    Gastrodiagnost
    HSDB 3247
    Pentagastrina [INN-Spanish]
    Pentagastrine [INN-French]
    Pentagastrinum [INN-Latin]
    pentagastrin
    Peptavlon
    Petogasrin
    3-[(1-carbamoyl-2-phenyl-ethyl)carbamoyl]-3-[[2-[[3-(1H-indol-3-yl)-2-[3-(2-methylpropoxycarbonylamino)propanoylamino]propanoyl]amino]-4-methylsulfanyl-butanoyl]amino]propanoic acid

Registries:
    PubChem CID 21701
    PubChem ID 164419