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1-(2-aminopropanoyl)pyrrolidine-2-carboxylic acid

AlkaPlorer ID: AK124612

Synonym: None

IUPAC Name: (2S)-1-[(2S)-2-aminopropanoyl]pyrrolidine-2-carboxylic acid

Structure

SMILES: C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O

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InChI: InChI=1S/C8H14N2O3/c1-5(9)7(11)10-4-2-3-6(10)8(12)13/h5-6H,2-4,9H2,1H3,(H,12,13)/t5-,6-/m0/s1

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InChIKey: WPWUFUBLGADILS-WDSKDSINSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Trypanosoma brucei Trypanosoma Trypanosomatidae Trypanosomatida Kinetoplastea Euglenozoa None Eukaryota

Properties Information

Molecule Weight: 186.211

TPSA？: 83.63000000000001

MolLogP？: -0.5907999999999995

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens Angiotensin-converting enzyme IC50 42000.0 nM 10.1021/jm00152a014
Homo sapiens Angiotensin-converting enzyme IC50 110000.0 nM 10.1021/jm00122a003
Homo sapiens Angiotensin-converting enzyme IC50 229086.77 nM 10.1021/jm00068a017
Homo sapiens Angiotensin-converting enzyme Ki 50000.0 nM 10.1016/S0960-894X(00)80669-1
Homo sapiens Angiotensin-converting enzyme logIC50 2.43 None 10.1016/j.ejmech.2014.07.015
Homo sapiens Oligopeptide transporter small intestine isoform Activity 8.0 % 10.1074/jbc.270.12.6456
Homo sapiens Oligopeptide transporter small intestine isoform Ki 150000.0 nM 10.1021/jm030976x
Homo sapiens Solute carrier family 15 member 2 Ki 12000.0 nM 10.1016/j.bmc.2011.06.027
Homo sapiens Solute carrier family 15 member 2 Ki 12022.64 nM 10.1016/j.bmc.2011.06.027
Oryctolagus cuniculus Angiotensin-converting enzyme IC50 270000.0 nM 10.1016/j.ejmech.2011.05.007
Oryctolagus cuniculus Angiotensin-converting enzyme Ki 30000.0 nM 10.1021/jm00148a008
Oryctolagus cuniculus Angiotensin-converting enzyme Ki 50000.0 nM 10.1021/jm00148a008
Rattus norvegicus Tripeptidyl aminopeptidase Ki 1400000.0 nM 10.1021/jm990226g

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT005628 CC(C)C[C@H](N)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O enzymemap_66176
AKRT011100 COC(=O)[C@H](CCC(=O)O)NC(=O)OCc1ccccc1.C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O>>C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H]1C(=O)O enzymemap_69024
AKRT013381 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O enzymemap_66765
AKRT013385 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O enzymemap_66728
AKRT013386 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O None
AKRT013388 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O enzymemap_66729
AKRT013389 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O.N[C@@H](CO)C(=O)O None
AKRT013393 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O enzymemap_66730
AKRT013394 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O None
AKRT013396 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O enzymemap_66224
AKRT013397 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O.Nc1ccc([N+](=O)[O-])cc1 None
AKRT013399 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O enzymemap_66841
AKRT013400 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O.Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1 None
AKRT013403 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)Nc1ccc2c(c1)Oc1cc(N)ccc1C21OC(=O)c2ccccc21>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O enzymemap_67073
AKRT013404 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)Nc1ccc2c(c1)Oc1cc(NC(=O)CCCCCN3C(=O)C(Cl)=C(Cl)C3=O)ccc1C21OC(=O)c2ccccc21>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O enzymemap_67072
AKRT013405 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)Nc1ccc2c(c1)Oc1cc(NC(=O)[C@@H]3CCCN3C(=O)[C@H](C)N)ccc1C21OC(=O)c2ccccc21>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O enzymemap_67073
AKRT013406 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O>>C[C@H](N)C(=O)O enzymemap_65966
AKRT013407 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O>>C[C@H](N)C(=O)O.O=C(O)[C@@H]1CCCN1 None
AKRT013408 C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O>>O=C(O)[C@@H]1CCCN1 enzymemap_65966
AKRT013694 C[C@H](NC(=O)CCCC(=O)O)C(=O)N1CCC[C@H]1C(=O)O>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O enzymemap_78222
AKRT013717 C[C@H](NC(=O)CNC(=O)c1ccccc1)C(=O)N1CCC[C@H]1C(=O)O>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O enzymemap_67163
AKRT013868 C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1C(=O)O>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O enzymemap_67183
AKRT014917 Cc1cc(=O)oc2cc(NC(=O)[C@@H]3CCCN3C(=O)[C@H](C)N)ccc12>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O enzymemap_66976