P6C
Summary
| Name: | 2-AMINO-4-ISOPROPYL-PTERIDINE-6-CARBOXYLIC ACID |
| Formula: | C10 H11 N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 233.227 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-amino-4-(1-methylethyl)pteridine-6-carboxylic acid |
| OpenEye OEToolkits | 1.5.0 | 2-amino-4-propan-2-yl-pteridine-6-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)c1nc2c(nc1)nc(nc2C(C)C)N |
| SMILES_CANONICAL | CACTVS | 3.341 | CC(C)c1nc(N)nc2ncc(nc12)C(O)=O |
| SMILES | CACTVS | 3.341 | CC(C)c1nc(N)nc2ncc(nc12)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(C)c1c2c(ncc(n2)C(=O)O)nc(n1)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(C)c1c2c(ncc(n2)C(=O)O)nc(n1)N |
| InChI | InChI | 1.03 | InChI=1S/C10H11N5O2/c1-4(2)6-7-8(15-10(11)14-6)12-3-5(13-7)9(16)17/h3-4H,1-2H3,(H,16,17)(H2,11,12,14,15) |
| InChIKey | InChI | 1.03 | GPHPGFBRJYCUDO-UHFFFAOYSA-N |
