EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H11N5O4 |
| Net Charge | 0 |
| Average Mass | 253.218 |
| Monoisotopic Mass | 253.08110 |
| SMILES | Nc1nc(=O)c2nc([C@@H](O)[C@@H](O)CO)cnc2n1 |
| InChI | InChI=1S/C9H11N5O4/c10-9-13-7-5(8(18)14-9)12-3(1-11-7)6(17)4(16)2-15/h1,4,6,15-17H,2H2,(H3,10,11,13,14,18)/t4-,6+/m0/s1 |
| InChIKey | BMQYVXCPAOLZOK-UJURSFKZSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| L-erythro-neopterin (CHEBI:232415) is a neopterin (CHEBI:28670) |
| IUPAC Name |
|---|
| 2-amino-6-[(1R,2S)-1,2,3-trihydroxypropyl]pteridin-4(3H)-one |
| Synonym | Source |
|---|---|
| L-(−)-neopterin | ChEBI |
| Registry Numbers | Sources |
|---|---|
| CAS:2277-43-2 | ChEBI |