1.0
2020-04-20 20:00:57 UTC
2020-04-21 18:03:39 UTC
FDB112370
Glutamylphenylalanine
C14H18N2O5
294.307
294.121571688
N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
InChI=1S/C14H18N2O5/c15-10(6-7-12(17)18)13(19)16-11(14(20)21)8-9-4-2-1-3-5-9/h1-5,10-11H,6-8,15H2,(H,16,19)(H,17,18)(H,20,21)/t10-,11-/m0/s1
XMBSYZWANAQXEV-QWRGUYRKSA-N
belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
Dipeptides
Organic compounds
Organic acids and derivatives
Carboxylic acids and derivatives
Amino acids, peptides, and analogues
Aromatic homomonocyclic compounds
Alpha amino acid amides
Amino acids
Amino fatty acids
Amphetamines and derivatives
Carbonyl compounds
Carboxylic acids
Dicarboxylic acids and derivatives
Glutamic acid and derivatives
Hydrocarbon derivatives
Monoalkylamines
N-acyl amines
N-acyl-L-alpha-amino acids
Organic oxides
Organopnictogen compounds
Phenylalanine and derivatives
Phenylpropanoic acids
Secondary carboxylic acid amides
3-phenylpropanoic-acid
Alpha-amino acid amide
Alpha-amino acid or derivatives
Alpha-dipeptide
Amine
Amino acid
Amino acid or derivatives
Amino fatty acid
Amphetamine or derivatives
Aromatic homomonocyclic compound
Benzenoid
Carbonyl group
Carboxamide group
Carboxylic acid
Dicarboxylic acid or derivatives
Fatty acyl
Fatty amide
Glutamic acid or derivatives
Hydrocarbon derivative
Monocyclic benzene moiety
N-acyl-alpha amino acid or derivatives
N-acyl-alpha-amino acid
N-acyl-amine
N-acyl-l-alpha-amino acid
Organic nitrogen compound
Organic oxide
Organic oxygen compound
Organonitrogen compound
Organooxygen compound
Organopnictogen compound
Phenylalanine or derivatives
Primary aliphatic amine
Primary amine
Secondary carboxylic acid amide
average_mass
294.307
mono_mass
294.121571688
smiles
N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
formula
C14H18N2O5
inchi
InChI=1S/C14H18N2O5/c15-10(6-7-12(17)18)13(19)16-11(14(20)21)8-9-4-2-1-3-5-9/h1-5,10-11H,6-8,15H2,(H,16,19)(H,17,18)(H,20,21)/t10-,11-/m0/s1
inchikey
XMBSYZWANAQXEV-QWRGUYRKSA-N
Specdb::CMs
159787
Specdb::NmrOneD
108378
Specdb::NmrOneD
108379
Specdb::NmrOneD
108380
Specdb::NmrOneD
108381
Specdb::NmrOneD
108382
Specdb::NmrOneD
108383
Specdb::NmrOneD
108384
Specdb::NmrOneD
108385
Specdb::NmrOneD
108386
Specdb::NmrOneD
108387
Specdb::NmrOneD
108388
Specdb::NmrOneD
108389
Specdb::NmrOneD
108390
Specdb::NmrOneD
108391
Specdb::NmrOneD
108392
Specdb::NmrOneD
108393
Specdb::NmrOneD
108394
Specdb::NmrOneD
108395
Specdb::NmrOneD
108396
Specdb::NmrOneD
108397
Specdb::MsMs
1235767
Specdb::MsMs
1235768
Specdb::MsMs
1235769
Specdb::MsMs
1351240
Specdb::MsMs
1351241
Specdb::MsMs
1351242
Specdb::MsMs
2464809
Specdb::MsMs
2464810
Specdb::MsMs
2464811
Specdb::MsMs
2501132
Specdb::MsMs
2501133
Specdb::MsMs
2501134
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