ROI
Summary
| Name: | 7,8-DIHYDRO-7,7-DIMETHYL-6-HYDROXYPTERIN |
| Formula: | C8 H11 N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 209.205 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-amino-6-hydroxy-7,7-dimethyl-7,8-dihydropteridin-4(3H)-one |
| OpenEye OEToolkits | 1.5.0 | 2-amino-6-hydroxy-7,7-dimethyl-3,8-dihydropteridin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1C=2N=C(O)C(NC=2N=C(N1)N)(C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CC1(C)NC2=C(N=C1O)C(=O)NC(=N2)N |
| SMILES | CACTVS | 3.341 | CC1(C)NC2=C(N=C1O)C(=O)NC(=N2)N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC1(C(=NC2=C(N1)N=C(NC2=O)N)O)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1(C(=NC2=C(N1)N=C(NC2=O)N)O)C |
| InChI | InChI | 1.03 | InChI=1S/C8H11N5O2/c1-8(2)6(15)10-3-4(13-8)11-7(9)12-5(3)14/h1-2H3,(H,10,15)(H4,9,11,12,13,14) |
| InChIKey | InChI | 1.03 | JMLQSLXEUWNWFI-UHFFFAOYSA-N |
