GA0

GLYCYLALANYL-N-2-NAPHTHYL-L-PROLINEAMIDE

Created:2006-01-16
Last modified:  2020-06-05

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Chemical Details

Formal Charge0
Atom Count51
Chiral Atom Count2
Bond Count53
Aromatic Bond Count11
2D diagram of GA0

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Toggle HydrogenToggle Labels

Chemical Component Summary

NameGLYCYLALANYL-N-2-NAPHTHYL-L-PROLINEAMIDE
SynonymsGLYCYL-ALANYL-PROLINE-BETA-NAPHTHYLAMIDE
Systematic Name (OpenEye OEToolkits)(2S)-1-[(2S)-2-(2-aminoethanoylamino)propanoyl]-N-naphthalen-2-yl-pyrrolidine-2-carboxamide
FormulaC20 H24 N4 O3
Molecular Weight368.43
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(Nc2cc1ccccc1cc2)C3N(C(=O)C(NC(=O)CN)C)CCC3
SMILESCACTVS3.341C[CH](NC(=O)CN)C(=O)N1CCC[CH]1C(=O)Nc2ccc3ccccc3c2
SMILESOpenEye OEToolkits1.5.0CC(C(=O)N1CCCC1C(=O)Nc2ccc3ccccc3c2)NC(=O)CN
Canonical SMILESCACTVS3.341 C[C@H](NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)Nc2ccc3ccccc3c2
Canonical SMILESOpenEye OEToolkits1.5.0 C[C@@H](C(=O)N1CCC[C@H]1C(=O)Nc2ccc3ccccc3c2)NC(=O)CN
InChIInChI1.03 InChI=1S/C20H24N4O3/c1-13(22-18(25)12-21)20(27)24-10-4-7-17(24)19(26)23-16-9-8-14-5-2-3-6-15(14)11-16/h2-3,5-6,8-9,11,13,17H,4,7,10,12,21H2,1H3,(H,22,25)(H,23,26)/t13-,17-/m0/s1
InChIKeyInChI1.03 KCELZXZDIUJGNM-GUYCJALGSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB07813 
NameGLYCYLALANYL-N-2-NAPHTHYL-L-PROLINEAMIDE
Groups experimental
SynonymsGLYCYLALANYL-N-2-NAPHTHYL-L-PROLINEAMIDE

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
NameTarget SequencePharmacological ActionActions
Prolyl tripeptidyl peptidaseMKKTIFQQLFLSVCALTVALPCSAQSPETSGKEFTLEQLMPGGKEFYNFY...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 46937094