5-Hydroxytryptophan; (±)-form
AlkaPlorer ID: AK302144
Synonym: None
IUPAC Name: 2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoic acid
Structure
SMILES: NC(CC1=CNC2=C1C=C(O)C=C2)C(=O)O
InChI: InChI=1S/C11H12N2O3/c12-9(11(15)16)3-6-5-13-10-2-1-7(14)4-8(6)10/h1-2,4-5,9,13-14H,3,12H2,(H,15,16)
InChIKey: LDCYZAJDBXYCGN-UHFFFAOYSA-N
Reference
A community-driven global reconstruction of human metabolism
PubChem CID: 25243949
CAS: 4350-09-8
LOTUS: LTS0198808
NPASS: NPC315491
COCONUT: CNP0403850.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Panaeolus | Galeropsidaceae | Agaricales | Agaricomycetes | Basidiomycota | Fungi | Eukaryota |
| Mucuna pruriens | Mucuna | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Griffonia | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 220.228
TPSA？: 99.34000000000002
MolLogP？: 0.8279000000000001
Number of H-Donors: 4
Number of H-Acceptors: 3
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Felis catus | Felis catus | BP | -24.0 | mmHg | 10.1021/jm00348a022 |
| Felis catus | Felis catus | BP | 162.0 | mmHg | 10.1021/jm00348a022 |
| Homo sapiens | Histone deacetylase 6 | Inhibition | -5.11 | % | 10.6019/CHEMBL4808148 |
| Homo sapiens | Histone deacetylase 6 | Inhibition | 9.26 | % | 10.6019/CHEMBL4808148 |
| Rattus norvegicus | Rattus norvegicus | BP | -9.0 | mmHg | 10.1021/jm00348a022 |
| Rattus norvegicus | Rattus norvegicus | BP | -5.0 | mmHg | 10.1021/jm00348a022 |
| Rattus norvegicus | Rattus norvegicus | BP | -1.0 | mmHg | 10.1021/jm00348a022 |
| Rattus norvegicus | Rattus norvegicus | BP | 0.0 | mmHg | 10.1021/jm00348a022 |
| Rattus norvegicus | Rattus norvegicus | BP | 6.0 | mmHg | 10.1021/jm00348a022 |
| Severe acute respiratory syndrome coronavirus 2 | SARS-CoV-2 | IC50 | 19952.62 | nM | 10.6019/CHEMBL4651402 |
| Severe acute respiratory syndrome coronavirus 2 | SARS-CoV-2 | IC50 | 20000.0 | nM | 10.6019/CHEMBL4651402 |
| None | NON-PROTEIN TARGET | Potency | 265.9 | nM | None |
| None | NON-PROTEIN TARGET | Potency | 595.2 | nM | None |