HHR
Summary
| Name: | 6-HYDROXYMETHYLPTERIN |
| Formula: | C7 H7 N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 193.163 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-amino-6-(hydroxymethyl)pteridin-4(3H)-one |
| OpenEye OEToolkits | 1.5.0 | 2-amino-6-(hydroxymethyl)-3H-pteridin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1c2nc(cnc2N=C(N1)N)CO |
| SMILES_CANONICAL | CACTVS | 3.341 | NC1=Nc2ncc(CO)nc2C(=O)N1 |
| SMILES | CACTVS | 3.341 | NC1=Nc2ncc(CO)nc2C(=O)N1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1c(nc2c(n1)N=C(NC2=O)N)CO |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1c(nc2c(n1)N=C(NC2=O)N)CO |
| InChI | InChI | 1.03 | InChI=1S/C7H7N5O2/c8-7-11-5-4(6(14)12-7)10-3(2-13)1-9-5/h1,13H,2H2,(H3,8,9,11,12,14) |
| InChIKey | InChI | 1.03 | XGWIBNWDLMIPNF-UHFFFAOYSA-N |
