Adenosine-5'-phosphosulfate
Internal ID | d1ba57d8-d1e7-44a8-bc54-61f38f288cc4 |
Taxonomy | Nucleosides, nucleotides, and analogues > Purine nucleotides > Purine ribonucleotides > Purine ribonucleoside monophosphates |
IUPAC Name | [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl sulfo hydrogen phosphate |
SMILES (Canonical) | C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OS(=O)(=O)O)O)O)N |
SMILES (Isomeric) | C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OS(=O)(=O)O)O)O)N |
InChI | InChI=1S/C10H14N5O10PS/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-26(18,19)25-27(20,21)22/h2-4,6-7,10,16-17H,1H2,(H,18,19)(H2,11,12,13)(H,20,21,22)/t4-,6-,7-,10-/m1/s1 |
InChI Key | IRLPACMLTUPBCL-KQYNXXCUSA-N |
Popularity | 300 references in papers |
Molecular Formula | C10H14N5O10PS |
Molecular Weight | 427.29 g/mol |
Exact Mass | 427.01989983 g/mol |
Topological Polar Surface Area (TPSA) | 238.00 Ų |
XlogP | -3.90 |
5'-Adenylyl sulfate |
Adenosine 5'-phosphosulfate |
adenosine phosphosulfate |
ADENOSINE-5'-PHOSPHOSULFATE |
485-84-7 |
AMPS |
Adenosine sulfatophosphate |
Adenylylsulfate |
CHEBI:17709 |
5'-Adenylic acid, monoanhydride with sulfuric acid |
There are more than 10 synonyms. If you wish to see them all click here. |
Target | Value | Probability (raw) | Probability (%) |
---|---|---|---|
No predicted properties yet! |
Proven Targets:
CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
---|---|---|---|---|---|
No proven targets yet! |
Predicted Targets (via Super-PRED):
CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
---|---|---|---|---|
CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 98.12% | 96.09% |
CHEMBL1075162 | Q13304 | Uracil nucleotide/cysteinyl leukotriene receptor | 98.06% | 80.33% |
CHEMBL3401 | O75469 | Pregnane X receptor | 94.78% | 94.73% |
CHEMBL3137261 | O14744 | PRMT5/MEP50 complex | 93.44% | 100.00% |
CHEMBL226 | P30542 | Adenosine A1 receptor | 93.05% | 95.93% |
CHEMBL4040 | P28482 | MAP kinase ERK2 | 90.07% | 83.82% |
CHEMBL2243 | O00519 | Anandamide amidohydrolase | 88.79% | 97.53% |
CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 87.72% | 95.56% |
CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 86.86% | 94.00% |
CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 84.45% | 99.23% |
CHEMBL3230 | O95977 | Sphingosine 1-phosphate receptor Edg-6 | 83.57% | 94.01% |
CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 83.47% | 95.89% |
CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 82.68% | 96.00% |
CHEMBL4523377 | Q86WV6 | Stimulator of interferon genes protein | 82.64% | 95.48% |
CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 82.26% | 89.00% |
CHEMBL3891 | P07384 | Calpain 1 | 81.97% | 93.04% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
To see more specific details click the taxa you are interested in.
To see more specific details click the taxa you are interested in.
Arabidopsis thaliana |
PubChem | 10238 |
LOTUS | LTS0138833 |
wikiData | Q356138 |