Navigation

name Structure Reference Source Properties Activities Metabolism

5-Aminopentanoic acid

AlkaPlorer ID: AK008640

Synonym: None

IUPAC Name: 5-aminopentanoic acid

Structure

SMILES: NCCCCC(=O)O

copy

InChI: InChI=1S/C5H11NO2/c6-4-2-1-3-5(7)8/h1-4,6H2,(H,7,8)

copy

InChIKey: JJMDCOVWQOJGCB-UHFFFAOYSA-N

copy

Source

Species Genus Family Order Class Phylum Kingdom Domain
Homo sapiens Homo Hominidae Primates Mammalia Chordata Metazoa Eukaryota

Properties Information

Molecule Weight: 117.14799999999998

TPSA？: 63.32000000000001

MolLogP？: 0.2000000000000001

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens Cerebroside-sulfatase Potency 5358.2 nM None
Homo sapiens Cytochrome P450 1A2 AC50 nan None None
Homo sapiens Cytochrome P450 2C19 AC50 nan None None
Homo sapiens Cytochrome P450 2C9 AC50 nan None None
Homo sapiens Cytochrome P450 2D6 AC50 nan None None
Homo sapiens Cytochrome P450 2D6 Potency 3981.1 nM None
Homo sapiens Cytochrome P450 3A4 AC50 nan None None
Homo sapiens GABA-C receptor Kb 20000.0 nM 10.1021/jm9904349
Homo sapiens GABA receptor rho-1 subunit Kb 20000.0 nM 10.1021/jm7015842
Homo sapiens Nuclear factor NF-kappa-B p105 subunit Potency 8912.5 nM None
Homo sapiens Oligopeptide transporter small intestine isoform Ki 17400000.0 nM 10.1021/jm030976x
Mus musculus GABA transporter 1 IC50 74131.02 nM 10.1016/j.ejmech.2011.01.042
Mus musculus GABA transporter 3 IC50 134896.29 nM 10.1016/j.ejmech.2011.01.042
Mus musculus GABA transporter 4 IC50 190546.07 nM 10.1016/j.ejmech.2011.01.042
Rattus norvegicus Thioredoxin reductase 1, cytoplasmic Potency 8436.8 nM None
Trypanosoma brucei 6-phospho-1-fructokinase Potency 756.9 nM None
None Unchecked IC50 501187.23 nM 10.1016/j.ejmech.2011.01.042
None Unchecked Ki 4100000.0 nM 10.1021/jm00091a009

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT002084 CC(=O)C(=O)O.NCCCCC(=O)O>>C[C@H](N)C(=O)O.O=CCCCC(=O)O None
AKRT002417 CC(=O)NCCCCC(=O)O>>NCCCCC(=O)O AMVAL-RXN
AKRT004074 CC(=O)O.NCCCCC(=O)O>>CC(=O)NCCCCC(=O)O R02276
AKRT004622 CC(=O)[CoA].NCCCCC(=O)O.O=C(O)CC(=O)[CoA].O=C(O)CC(=O)[CoA].O=C(O)CC(=O)[CoA].O=C(O)CC(=O)[CoA].O=C(O)CC(=O)[CoA].O=C(O)CC(=O)[CoA].O=C(O)CC(=O)[CoA].O=C(O)CC(=O)[CoA]>>C[C@@H](O)C/C=C/CCCCCCCCCC/C=C/C(=O)NCCCCC(=O)O 66812
AKRT004623 CC(=O)[CoA].NCCCCC(=O)O.O=C(O)CC(=O)[CoA].O=C(O)CC(=O)[CoA].O=C(O)CC(=O)[CoA].O=C(O)CC(=O)[CoA].O=C(O)CC(=O)[CoA]>>C[C@@H](O)C/C=C/CCCCCCCC/C=C/C(=O)NCCCCC(=O)O 66808
AKRT009729 CCOC(=O)[C@H](CCCNC(=N)N)NC(=O)c1ccccc1.NCCCCC(=O)O>>N=C(N)NCCC[C@H](NC(=O)c1ccccc1)C(=O)NCCCCC(=O)O enzymemap_73503
AKRT011026 COC(=O)CCCCN>>NCCCCC(=O)O enzymemap_77165
AKRT015884 N=C(N)NCCCCC(=O)O>>NCCCCC(=O)O enzymemap_79036
AKRT017069 NC(=O)NCCCCC(=O)O>>NCCCCC(=O)O enzymemap_77690
AKRT017902 NCCCCC(=O)C(=O)O>>NCCCCC(=O)O RXN-8243
AKRT017907 NCCCCC(=O)O.N=C(N)NCCC[C@H](N)C(=O)O>>N=C(N)NCCCCC(=O)O enzymemap_28156
AKRT017908 NCCCCC(=O)O.O=C(O)CCC(=O)C(=O)O>>NCCC[C@@H](O)C(=O)O.O=C(O)CCC(=O)O.O=C=O None
AKRT017909 NCCCCC(=O)O.O=C(O)CCC(=O)C(=O)O>>N[C@@H](CCC(=O)O)C(=O)O VAGL-RXN
AKRT017910 NCCCCC(=O)O.O=C(O)CCC(=O)C(=O)O>>N[C@@H](CCC(=O)O)C(=O)O.O=CCCCC(=O)O None
AKRT017911 NCCCCC(=O)O.O=C(O)CCC(=O)C(=O)O>>O=CCCCC(=O)O VAGL-RXN
AKRT017912 NCCCCC(=O)O>>C1=NCCCC1 MNXR103138
AKRT017913 NCCCCC(=O)O>>NCCCCC(N)=O None
AKRT017914 NCCCCC(=O)O>>NCCCCCN MNXR155674
AKRT017915 NCCCCC(=O)O>>NCCC[C@@H](O)C(=O)O enzymemap_10610
AKRT017916 NCCCCC(=O)O>>O=C(O)[C@H]1CCCN1 enzymemap_19240
AKRT017917 NCCCCC(=O)O>>O=CCCCC(=O)O enzymemap_22263
AKRT017918 NCCCCC(N)=O>>NCCCCC(=O)O 5-AMINOPENTANAMIDASE-RXN
AKRT017924 NCCCCC=O>>NCCCCC(=O)O RXN0-7318
AKRT023104 O=C(O)[C@H]1CCCN1>>NCCCCC(=O)O R02825
AKRT023672 O=CCCCC(=O)O>>NCCCCC(=O)O R02274