Navigation

name Structure Reference Source Properties Activities Metabolism

(7Z,10Z,13Z,16Z)-N-(2-hydroxyethyl)docosa-7,10,13,16-tetraenamide

AlkaPlorer ID: AK320636

Synonym: None

IUPAC Name: (7Z,10Z,13Z,16Z)-N-(2-hydroxyethyl)docosa-7,10,13,16-tetraenamide

Structure

SMILES: CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(O)=NCCO

copy

InChI: InChI=1S/C24H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(27)25-22-23-26/h6-7,9-10,12-13,15-16,26H,2-5,8,11,14,17-23H2,1H3,(H,25,27)/b7-6-,10-9-,13-12-,16-15-

copy

InChIKey: FMVHVRYFQIXOAF-DOFZRALJSA-N

copy

Source

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

Properties Information

Molecule Weight: 375.5970000000002

TPSA？: 52.82000000000001

MolLogP？: 6.861100000000008

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Bacillus subtilis 4'-phosphopantetheinyl transferase ffp Potency 25118.9 nM None
Bacillus subtilis 4'-phosphopantetheinyl transferase ffp Potency 89125.1 nM None
Equus caballus Ferritin light chain Potency 25118.9 nM None
Homo sapiens 15-hydroxyprostaglandin dehydrogenase [NAD+] Potency 35481.3 nM None
Homo sapiens Aldehyde dehydrogenase 1A1 Potency 14125.4 nM None
Homo sapiens Aldehyde dehydrogenase 1A1 Potency 44668.4 nM None
Homo sapiens Arachidonate 12-lipoxygenase Potency 39810.7 nM None
Homo sapiens Beta-glucocerebrosidase Potency 31622.8 nM None
Homo sapiens Bloom syndrome protein Potency 28183.8 nM None
Homo sapiens Cannabinoid CB1 receptor Ki 34.4 nM 10.1021/jm0200761
Homo sapiens DNA-(apurinic or apyrimidinic site) lyase Potency 35481.3 nM None
Homo sapiens DNA polymerase kappa Potency 39810.7 nM None
Homo sapiens Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 Potency 12589.3 nM None
Homo sapiens Menin/Histone-lysine N-methyltransferase MLL Potency 17782.8 nM None
Homo sapiens Microtubule-associated protein tau Potency 39810.7 nM None
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 39810.7 nM None
Homo sapiens Vitamin D receptor Potency 35481.3 nM None
Mus musculus Cannabinoid receptor Ki 34.4 nM 10.1021/jm00072a026
Mus musculus RAW264.7 Activity 65.0 % 10.1016/j.bmc.2008.10.015
Rattus norvegicus Cannabinoid CB1 receptor Ki 34.0 nM 10.1021/jm058183t
Rattus norvegicus Cannabinoid CB1 receptor Ki 34.4 nM 10.1021/jm960752x
None ADMET Activity 24.0 % 10.1016/j.bmc.2008.10.015

Metabolism Information