Cysteine-S-sulfate
AlkaPlorer ID: AK017051
Synonym: None
IUPAC Name: (2R)-2-amino-3-sulfosulfanylpropanoic acid
Structure
SMILES: N[C@@H](CSS(=O)(=O)O)C(=O)O
InChI: InChI=1S/C3H7NO5S2/c4-2(3(5)6)1-10-11(7,8)9/h2H,1,4H2,(H,5,6)(H,7,8,9)/t2-/m0/s1
InChIKey: NOKPBJYHPHHWAN-REOHCLBHSA-N
Reference
Ahomocysteinemia in molybdenum cofactor deficiency
PubChem CID: 115015
CAS: 1637-71-4
LOTUS: LTS0007830
NPASS: NPC228932
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Rhinoceros sondaicus | Rhinoceros | Rhinocerotidae | Perissodactyla | Mammalia | Chordata | Metazoa | Eukaryota |
| Rhinoceros unicornis | Rhinoceros | Rhinocerotidae | Perissodactyla | Mammalia | Chordata | Metazoa | Eukaryota |
| Homo sapiens | Homo | Hominidae | Primates | Mammalia | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 201.225
TPSA？: 117.69
MolLogP？: -1.0657
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bacillus anthracis | Anthrax lethal factor | Potency | 31622.8 | nM | None |
| Bacillus subtilis | 4'-phosphopantetheinyl transferase ffp | Potency | 3548.1 | nM | None |
| Bacillus subtilis | 4'-phosphopantetheinyl transferase ffp | Potency | 35481.3 | nM | None |
| Bacillus subtilis | 4'-phosphopantetheinyl transferase ffp | Potency | 44668.4 | nM | None |
| Giardia intestinalis | Putative fructose-1,6-bisphosphate aldolase | Potency | 22387.2 | nM | None |
| Helicobacter pylori (strain ATCC 700392 / 26695) (Campylobacterpylori) | Aspartate-semialdehyde dehydrogenase | IC50 | 180.0 | nM | 10.1021/np049595s |
| Homo sapiens | 15-hydroxyprostaglandin dehydrogenase [NAD+] | Potency | 28183.8 | nM | None |
| Homo sapiens | Aldehyde dehydrogenase 1A1 | Potency | 35481.3 | nM | None |
| Homo sapiens | Arachidonate 15-lipoxygenase, type II | Potency | 6309.6 | nM | None |
| Homo sapiens | Cytochrome P450 1A2 | AC50 | 39810.72 | nM | None |
| Homo sapiens | Cytochrome P450 2C19 | AC50 | 7943.28 | nM | None |
| Homo sapiens | Cytochrome P450 2C19 | Potency | 7943.3 | nM | None |
| Homo sapiens | Cytochrome P450 2C9 | AC50 | 12589.25 | nM | None |
| Homo sapiens | Cytochrome P450 2C9 | Potency | 12589.3 | nM | None |
| Homo sapiens | Cytochrome P450 2D6 | AC50 | nan | None | None |
| Homo sapiens | Cytochrome P450 3A4 | AC50 | nan | None | None |
| Homo sapiens | DNA-(apurinic or apyrimidinic site) lyase | Potency | 39810.7 | nM | None |
| Homo sapiens | Endoplasmic reticulum-associated amyloid beta-peptide-binding protein | Potency | 158.5 | nM | None |
| Homo sapiens | Endoplasmic reticulum-associated amyloid beta-peptide-binding protein | Potency | 31622.8 | nM | None |
| Homo sapiens | Glyceraldehyde-3-phosphate dehydrogenase liver | Potency | 22387.2 | nM | None |
| Homo sapiens | Histone acetyltransferase GCN5 | Potency | 35481.3 | nM | None |
| Homo sapiens | Histone deacetylase 6 | Inhibition | 0.97 | % | 10.6019/CHEMBL4808148 |
| Homo sapiens | Histone deacetylase 6 | Inhibition | 16.13 | % | 10.6019/CHEMBL4808148 |
| Homo sapiens | Lysine-specific demethylase 4D-like | Potency | 25118.9 | nM | None |
| Homo sapiens | Microtubule-associated protein tau | Potency | 3548.1 | nM | None |
| Homo sapiens | Microtubule-associated protein tau | Potency | 4466.8 | nM | None |
| Homo sapiens | Microtubule-associated protein tau | Potency | 12589.3 | nM | None |
| Homo sapiens | Microtubule-associated protein tau | Potency | 17782.8 | nM | None |
| Homo sapiens | Regulator of G-protein signaling 4 | Potency | 23778.1 | nM | None |
| Homo sapiens | Runt-related transcription factor 1/Core-binding factor subunit beta | Potency | 3981.1 | nM | None |
| Homo sapiens | Tyrosyl-DNA phosphodiesterase 1 | Potency | 22387.2 | nM | None |
| Homo sapiens | Tyrosyl-DNA phosphodiesterase 1 | Potency | 39810.7 | nM | None |
| Homo sapiens | Ubiquitin carboxyl-terminal hydrolase 1 | Potency | 39810.7 | nM | None |
| Homo sapiens | Vitamin D receptor | Potency | 10000.0 | nM | None |
| Homo sapiens | Vitamin D receptor | Potency | 50118.7 | nM | None |
| Oryctolagus cuniculus | Fructose-bisphosphate aldolase A | Potency | 14125.4 | nM | None |
| Severe acute respiratory syndrome coronavirus 2 | Replicase polyprotein 1ab | Inhibition | 6.347 | % | 10.6019/CHEMBL4495564 |
| Severe acute respiratory syndrome coronavirus 2 | SARS-CoV-2 | Inhibition | 0.47 | % | 10.6019/CHEMBL4495565 |
| Severe acute respiratory syndrome coronavirus 2 | SARS-CoV-2 | Inhibition | 26.37 | % | 10.21203/rs.3.rs-23951/v1 |
| None | Unchecked | Potency | 35481.3 | nM | None |