2-Amino-4,7-dihydroxy-6-pteridinecarboxylic acid
AlkaPlorer ID: AK008152
Synonym: 2-Amino-1,4,7,8-tetrahydro-4,7-dioxo-6-pteridinecarboxylic acid, Isoxanthopterincarboxylic acid, Cyprino-Pourpre B
IUPAC Name: 2-amino-4,7-dioxo-3,8-dihydropteridine-6-carboxylic acid
Structure
SMILES: NC1=NC2=C(N=C(C(=O)O)C(=O)N2)C(=O)N1
InChI: InChI=1S/C7H5N5O4/c8-7-11-3-1(4(13)12-7)9-2(6(15)16)5(14)10-3/h(H,15,16)(H4,8,10,11,12,13,14)
InChIKey: WFICTSPBINOLJT-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Carassius auratus | Carassius | Cyprinidae | Cypriniformes | Actinopteri | Chordata | Metazoa | Eukaryota |
| Litsea verticillata | Litsea | Lauraceae | Laurales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Pelophylax plancyi | Pelophylax | Ranidae | Anura | Amphibia | Chordata | Metazoa | Eukaryota |
| Pelophylax nigromaculatus | Pelophylax | Ranidae | Anura | Amphibia | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 223.148
TPSA？: 154.82
MolLogP？: -1.7132000000000005
Number of H-Donors: 4
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bacillus anthracis | Dihydropteroate synthase | IC50 | 269300.0 | nM | 10.1021/jm900861d |
| Bacillus anthracis | Dihydropteroate synthase | Inhibition | 70.0 | % | 10.1021/jm900861d |