1.0
2011-09-21 01:31:54 UTC
2015-07-21 06:59:16 UTC
FDB027914
19(S)-HETE
19(S)-HETE is an intermediate in Arachidonic acid metabolism. 19(S)-HETE is converted from Arachidonic acid via the enzyme CYP2U and Unspecific
Monooxygenase. (EC:1.14.14.1) [HMDB]
(19S,5Z,8Z,11Z,14Z)-19-Hydroxy-5,8,11,14-eicosatetraenoate
(19S,5Z,8Z,11Z,14Z)-19-Hydroxy-5,8,11,14-eicosatetraenoic acid
(19S)-Hydroxy arachidonate
(19S)-Hydroxy arachidonic acid
(19S)-Hydroxyeicosatetraenoate
(19S)-Hydroxyeicosatetraenoic acid
(19S)-Hydroxyicosatetraenoate
(19S)-Hydroxyicosatetraenoic acid
(5Z,8Z,11Z,14Z,19S)-19-Hydroxyeicosa-5,8,11,14-tetraenoate
(5Z,8Z,11Z,14Z,19S)-19-Hydroxyeicosa-5,8,11,14-tetraenoic acid
(5Z,8Z,11Z,14Z,19S)-19-Hydroxyicosa-5,8,11,14-tetraenoate
(5Z,8Z,11Z,14Z,19S)-19-Hydroxyicosa-5,8,11,14-tetraenoic acid
(5Z,8Z,11Z,14Z)-(19S)-19-Hydroxyeicosa-5,8,11,14-tetraenoate
(5Z,8Z,11Z,14Z)-(19S)-19-Hydroxyeicosa-5,8,11,14-tetraenoic acid
19(S)-HETE
19(S)-Hydroxy-all-cis-5,8,11,14-eicosatetraenoate
19(S)-Hydroxy-all-cis-5,8,11,14-eicosatetraenoic acid
19(S)-Hydroxyeicosa-5(Z),8(Z),11(Z),14(Z)-tetraenoate
19(S)-Hydroxyeicosa-5(Z),8(Z),11(Z),14(Z)-tetraenoic acid
C20H32O3
320.4663
320.23514489
(19S)-19-hydroxyicosa-5,8,11,14-tetraenoic acid
(19S)-19-hydroxyicosa-5,8,11,14-tetraenoic acid
79551-85-2
[H][C@@](C)(O)CCCC=CCC=CCC=CCC=CCCCC(O)=O
InChI=1S/C20H32O3/c1-19(21)17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18-20(22)23/h3-6,9-12,19,21H,2,7-8,13-18H2,1H3,(H,22,23)/t19-/m0/s1
XFUXZHQUWPFWPR-IBGZPJMESA-N
belongs to the class of organic compounds known as hydroxyeicosatetraenoic acids. These are eicosanoic acids with an attached hydroxyl group and four CC double bonds.
Hydroxyeicosatetraenoic acids
Organic compounds
Lipids and lipid-like molecules
Fatty Acyls
Eicosanoids
Aliphatic acyclic compounds
Carbonyl compounds
Carboxylic acids
Hydrocarbon derivatives
Hydroxy fatty acids
Long-chain fatty acids
Monocarboxylic acids and derivatives
Organic oxides
Secondary alcohols
Unsaturated fatty acids
Alcohol
Aliphatic acyclic compound
Carbonyl group
Carboxylic acid
Carboxylic acid derivative
Fatty acid
Hydrocarbon derivative
Hydroxy fatty acid
Hydroxyeicosatetraenoic acid
Long-chain fatty acid
Monocarboxylic acid or derivatives
Organic oxide
Organic oxygen compound
Organooxygen compound
Secondary alcohol
Unsaturated fatty acid
Solid
logp
5.80
logs
-5.25
solubility
1.79e-03 g/l
logp
5.12
pka_strongest_acidic
4.82
pka_strongest_basic
-1.6
iupac
(19S)-19-hydroxyicosa-5,8,11,14-tetraenoic acid
average_mass
320.4663
mono_mass
320.23514489
smiles
[H][C@@](C)(O)CCCC=CCC=CCC=CCC=CCCCC(O)=O
formula
C20H32O3
inchi
InChI=1S/C20H32O3/c1-19(21)17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18-20(22)23/h3-6,9-12,19,21H,2,7-8,13-18H2,1H3,(H,22,23)/t19-/m0/s1
inchikey
XFUXZHQUWPFWPR-IBGZPJMESA-N
polar_surface_area
57.53
refractivity
101.7
polarizability
38.18
rotatable_bond_count
14
acceptor_count
3
donor_count
2
physiological_charge
-1
formal_charge
0
Arachidonic Acid Metabolism
SMP00075
map00590
HMDB11136
34185
Anatidae
Type 1
specific
Anatidae
8830
Beefalo
Type 1
specific
Bos taurus X Bison bison
297284
Bison
Type 1
specific
Bison bison
9901
Buffalo
Type 1
specific
Bubalus bubalis
89462
Cattle (Beef, Veal)
Type 1
specific
Bos taurus
9913
Chicken
Type 1
specific
Gallus gallus
9031
Columbidae (Dove, Pigeon)
Type 1
specific
Columbidae
8930
Deer
Type 1
specific
Cervidae
9850
Domestic goat
Type 1
specific
Capra aegagrus hircus
9925
Domestic pig
Type 1
specific
Sus scrofa domestica
9825
Elk
Type 1
specific
Cervus canadensis
1574408
Emu
Type 1
specific
Dromaius novaehollandiae
8790
European rabbit
Type 1
specific
Oryctolagus
9984
Greylag goose
Type 1
specific
Anser anser
8843
Guinea hen
Type 1
specific
Numida meleagris
8996
Horse
Type 1
specific
Equus caballus
9796
Mallard duck
Type 1
specific
Anas platyrhynchos
8839
Mountain hare
Type 1
specific
Lepus timidus
62621
Mule deer
Type 1
specific
Odocoileus
9871
Ostrich
Type 1
specific
Struthio camelus
8801
Pheasant
Type 1
specific
Phasianus colchicus
9054
Quail
Type 1
specific
Phasianidae
9005
Rabbit
Type 1
specific
Leporidae
9979
Rock ptarmigan
Type 1
specific
Lagopus muta
64668
Sheep (Mutton, Lamb)
Type 1
specific
Ovis aries
9940
Squab
Type 1
specific
Columba
8931
Turkey
Type 1
specific
Meleagris gallopavo
9103
Velvet duck
Type 1
specific
Melanitta fusca
371864
Wild boar
Type 1
specific
Sus scrofa
9823
Cytochrome P450 2D6
Q6NWU0
CYP2D6
Cytochrome P450, family 1, subfamily A, polypeptide 1
A0N0X8
CYP1A1