N7P

1-ACETYL-L-PROLINE

Created:	2003-02-21
Last modified:	2024-09-27

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2 entries where N7P is found as a standalone ligand1 entries where N7P is covalently linked to polymer or other heterogen groups 10 entries where N7P is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	1
Bond Count	22
Aromatic Bond Count	0

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Chemical Component Summary
Name	1-ACETYL-L-PROLINE
Synonyms	N-ACETYLPROLINE
Systematic Name (OpenEye OEToolkits)	(2~{S})-1-ethanoylpyrrolidine-2-carboxylic acid
Formula	C₇ H₁₁ N O₃
Molecular Weight	157.167
Type	L-PEPTIDE LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	OC(=O)C1N(C(=O)C)CCC1
SMILES	CACTVS	3.385	CC(=O)N1CCC[CH]1C(O)=O
SMILES	OpenEye OEToolkits	2.0.5	CC(=O)N1CCCC1C(=O)O
Canonical SMILES	CACTVS	3.385	CC(=O)N1CCC[C@H]1C(O)=O
Canonical SMILES	OpenEye OEToolkits	2.0.5	CC(=O)N1CCC[C@H]1C(=O)O
InChI	InChI	1.03	InChI=1S/C7H11NO3/c1-5(9)8-4-2-3-6(8)7(10)11/h6H,2-4H2,1H3,(H,10,11)/t6-/m0/s1
InChIKey	InChI	1.03	GNMSLDIYJOSUSW-LURJTMIESA-N

Drug Info: DrugBank

DrugBank ID	DB03360
Name	N-Acetylproline
Groups	experimental
Synonyms	Acetyl proline (2S)-1-acetylpyrrolidine-2-carboxylic acid N-acetyl-L-proline N-Acetylproline (S)-1-acetylpyrrolidine-2-carboxylic acid (S)-(-)-N-acetylproline 1-acetylproline (S)-N-acetylproline
Categories	Amino Acids Amino Acids, Cyclic Amino Acids, Peptides, and Proteins Imino Acids
CAS number	68-95-1

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
(5R)-carbapenem-3-carboxylate synthase	MSEIVKFNPVMASGFGAYIDHRDFLEAKTETIKNLLMRQGFVVVKNLDID...	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