6-Amino-7-methylpurine
AlkaPlorer ID: AK018803
Synonym: 7-Methyl-7H-purin-6-amine, 7-Methyladenine
IUPAC Name: 7-methylpurin-6-amine
Structure
SMILES: CN1C=NC2=NC=NC(N)=C21
InChI: InChI=1S/C6H7N5/c1-11-3-10-6-4(11)5(7)8-2-9-6/h2-3H,1H3,(H2,7,8,9)
InChIKey: HCGHYQLFMPXSDU-UHFFFAOYSA-N
Reference
Purine and Nucleoside Metabolites from the Antarctic Sponge <i>Isodictya erinacea</i>
PubChem CID: 71593
CAS: 935-69-3
LOTUS: LTS0275564
NPASS: NPC174114
COCONUT: CNP0210945
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Syzygium aromaticum | Syzygium | Myrtaceae | Myrtales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Muricella | Anthogorgiidae | Malacalcyonacea | Anthozoa | Cnidaria | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 149.15699999999998
TPSA？: 69.62
MolLogP？: -0.0545000000000001
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Adenosine A1 receptor | Ki | 100000.0 | nM | 10.1016/j.bmc.2009.02.030 |
| Homo sapiens | Adenosine A2a receptor | Ki | 100000.0 | nM | 10.1016/j.bmc.2009.02.030 |
| Homo sapiens | Adenosine A2b receptor | Ki | 30000.0 | nM | 10.1016/j.bmc.2009.02.030 |
| Homo sapiens | Adenosine A3 receptor | Ki | 100000.0 | nM | 10.1016/j.bmc.2009.02.030 |
| Homo sapiens | Phosphatidylinositol 4-kinase, PI4K | Inhibition | 27.3 | % | 10.1021/jm00170a005 |
| Perknaster fuscus | Perknaster fuscus | Activity | nan | None | 10.1021/np970358h |
| None | Unchecked | IC50 | nan | None | 10.1021/acs.jmedchem.7b01066 |