Phyto4Health

Tryptophan

Representations & DB's id
ChEBI: CHEBI:16828
ChEMBL: CHEMBL54976
PubChem: 6305
IUPAC: (2S)-2-amino-3-(1H-indol-3-yl)propanoic acid
Standard InChI: InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1
Standard InChI Key: QIVBCDIJIAJPQS-VIFPVBQESA-N
SMILES: OC(=O)[C@H](Cc1c[nH]c2c1cccc2)N

Molecular propeties
AlogP: 1.12
Hydrogen bonds acceptors: 2
Hydrogen bonds donors: 3
Rotatable bonds: 3
Number of rings: 2
Molecular Weight: 204.09
Topological polar surface area: 79.1
Number of aromatic rings: 2
Fsp3: 0.182
Number of carbons: 11

Plant sources

Part of plant Plant name Ref.
PlantBrassica juncea
PlantLavandula vera
FruitHumulus lupulus
PlantEucalyptus australiana

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Others66 %Canalicular multispecific organic anion transporter 1Q92887
Potency31622.8 nMLysine-specific demethylase 4D-likeB2RXH2
Potency89125.1 nMHistone-lysine N-methyltransferase MLLQ03164
Potency39810.7 nMThyroid stimulating hormone receptorP16473
Potency39810.7 nMMicrotubule-associated protein tauP10636
Potency12589.3 nMHypoxia-inducible factor 1 alphaQ16665
Potency84921.4 nMPeripheral myelin protein 22Q01453
Potency35481.3 nMPrelamin-A/CP02545
Potency12589.3 nMHypoxia-inducible factor 1 alphaQ16665
Potency50118.7 nMBloom syndrome proteinP54132
Potency50118.7 nMBloom syndrome proteinP54132
Potency794.3 nMM-phase phosphoprotein 8Q99549
Potency8436.8 nMHistone-lysine N-methyltransferase, H3 lysine-9 specific 3Q96KQ7
Potency4466.8 nMHistone-lysine N-methyltransferase, H3 lysine-9 specific 3Q96KQ7
Potency50118.7 nMBromodomain adjacent to zinc finger domain protein 2BQ9UIF8
Others0 %Serum albuminP02768
Others15.3 %Serum albuminP02768
Others0 %Serum albuminP02768
Others15.1 %Serum albuminP02768
Ki11500000 nMTryptophan 2,3-dioxygenaseP48775
Others94 %Indoleamine 2,3-dioxygenaseP14902
Others100 %Indoleamine 2,3-dioxygenaseP14902
Others100 %Indoleamine 2,3-dioxygenaseP14902
Others67 %Tryptophan 2,3-dioxygenaseP48775
Others100 %Tryptophan 2,3-dioxygenaseP48775