1.0
2011-09-21 01:55:01 UTC
2015-07-21 06:59:43 UTC
FDB029390
3-Hydroxy-cis-5-tetradecenoylcarnitine
A human metabolite taken as a putative food compound of mammalian origin [HMDB]
3-Hydroxy-5-tetradecenoylcarnitine
3-Hydroxy-5(Z)-tetradecenoylcarnitine
3-Hydroxy-5Z-tetradecenoylcarnitine
3-Hydroxytetradecenoylcarnitine
Hydroxytetradecenoyl-L-carnitine
C21H39NO5
385.5381
385.282823363
CCCCCCCC\C=C/CC(O)CC(=O)O[C@H]([N+](C)(C)C)CCC([O-])=O
InChI=1S/C21H39NO5/c1-5-6-7-8-9-10-11-12-13-14-18(23)17-21(26)27-19(22(2,3)4)15-16-20(24)25/h12-13,18-19,23H,5-11,14-17H2,1-4H3/b13-12-/t18?,19-/m0/s1
BCZXLGKYFZTAJX-JDWANTKOSA-N
belongs to the class of organic compounds known as beta hydroxy acids and derivatives. Beta hydroxy acids and derivatives are compounds containing a carboxylic acid substituted with a hydroxyl group on the C3 carbon atom.
Beta hydroxy acids and derivatives
Organic compounds
Organic acids and derivatives
Hydroxy acids and derivatives
Beta hydroxy acids and derivatives
Aliphatic acyclic compounds
Carbonyl compounds
Carboxylic acid esters
Carboxylic acid salts
Carboxylic acids
Dicarboxylic acids and derivatives
Fatty acid esters
Hydrocarbon derivatives
Organic oxides
Organic salts
Organic zwitterions
Organopnictogen compounds
Secondary alcohols
Tetraalkylammonium salts
Alcohol
Aliphatic acyclic compound
Beta-hydroxy acid
Carbonyl group
Carboxylic acid
Carboxylic acid derivative
Carboxylic acid ester
Carboxylic acid salt
Dicarboxylic acid or derivatives
Fatty acid ester
Fatty acyl
Hydrocarbon derivative
Organic nitrogen compound
Organic oxide
Organic oxygen compound
Organic salt
Organic zwitterion
Organonitrogen compound
Organooxygen compound
Organopnictogen compound
Secondary alcohol
Tetraalkylammonium salt
Solid
average_mass
385.5381
mono_mass
385.282823363
smiles
CCCCCCCC\C=C/CC(O)CC(=O)O[C@H]([N+](C)(C)C)CCC([O-])=O
formula
C21H39NO5
inchi
InChI=1S/C21H39NO5/c1-5-6-7-8-9-10-11-12-13-14-18(23)17-21(26)27-19(22(2,3)4)15-16-20(24)25/h12-13,18-19,23H,5-11,14-17H2,1-4H3/b13-12-/t18?,19-/m0/s1
inchikey
BCZXLGKYFZTAJX-JDWANTKOSA-N
Specdb::CMs
24035
Specdb::CMs
40120
Specdb::MsMs
319261
Specdb::MsMs
319262
Specdb::MsMs
319263
Specdb::MsMs
366310
Specdb::MsMs
366311
Specdb::MsMs
366312
HMDB13330
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