1.0
2011-09-21 00:15:04 UTC
2015-07-21 06:57:14 UTC
FDB022507
2-Aminomuconic acid
2-Aminomuconic acid is a product of the Tryptophan metabolism degradation pathway (kinurenine pathway), in a reaction catabolized by the enzyme aminocarboxymuconate semialdehyde decarboxylase [EC:4.1.1.45]. The kynurenine pathway is the major route of L-tryptophan degradation in mammals. (BioCyc) [HMDB]
2-aminohexa-2,4-dienedioate
2-aminohexa-2,4-dienedioic acid
2-Aminomuconate
2-Aminomuconic acid
o-Aminomuconate
C6H7NO4
157.1241
157.037507717
2-aminohexa-2,4-dienedioic acid
2-aminomuconic acid
4548-99-6
NC(=CC=CC(O)=O)C(O)=O
InChI=1S/C6H7NO4/c7-4(6(10)11)2-1-3-5(8)9/h1-3H,7H2,(H,8,9)(H,10,11)
ZRHONLCTYUYMIQ-UHFFFAOYSA-N
belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
Alpha amino acids
Organic compounds
Organic acids and derivatives
Carboxylic acids and derivatives
Amino acids, peptides, and analogues
Aliphatic acyclic compounds
Amino acids
Amino fatty acids
Carbonyl compounds
Carboxylic acids
Dicarboxylic acids and derivatives
Enamines
Hydrocarbon derivatives
Medium-chain fatty acids
Monoalkylamines
Organic oxides
Organopnictogen compounds
Unsaturated fatty acids
Aliphatic acyclic compound
Alpha-amino acid
Amine
Amino acid
Amino fatty acid
Carbonyl group
Carboxylic acid
Dicarboxylic acid or derivatives
Enamine
Fatty acid
Fatty acyl
Hydrocarbon derivative
Medium-chain fatty acid
Organic nitrogen compound
Organic oxide
Organic oxygen compound
Organonitrogen compound
Organooxygen compound
Organopnictogen compound
Primary aliphatic amine
Primary amine
Unsaturated fatty acid
Solid
logp
-0.05
logs
-1.76
solubility
2.75e+00 g/l
logp
-3.1
pka_strongest_acidic
2.58
pka_strongest_basic
8.37
iupac
2-aminohexa-2,4-dienedioic acid
average_mass
157.1241
mono_mass
157.037507717
smiles
NC(=CC=CC(O)=O)C(O)=O
formula
C6H7NO4
inchi
InChI=1S/C6H7NO4/c7-4(6(10)11)2-1-3-5(8)9/h1-3H,7H2,(H,8,9)(H,10,11)
inchikey
ZRHONLCTYUYMIQ-UHFFFAOYSA-N
polar_surface_area
100.62
refractivity
38.55
polarizability
14.05
rotatable_bond_count
3
acceptor_count
5
donor_count
3
physiological_charge
-1
formal_charge
0
HMDB01241
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
2-amino-3-carboxymuconate-6-semialdehyde decarboxylase
Q8TDX5
ACMSD