EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H25N5O10 |
| Net Charge | 0 |
| Average Mass | 495.445 |
| Monoisotopic Mass | 495.16014 |
| SMILES | C[C@@H]([C@H](N)C(=O)N[C@@H](C(=O)O)[C@@H]1O[C@H](c2cnc(=O)nc2=O)[C@H](O)[C@@H]1O)[C@@H](O)c1ccc(O)cn1 |
| InChI | InChI=1S/C20H25N5O10/c1-6(12(27)9-3-2-7(26)4-22-9)10(21)18(31)24-11(19(32)33)16-14(29)13(28)15(35-16)8-5-23-20(34)25-17(8)30/h2-6,10-16,26-29H,21H2,1H3,(H,24,31)(H,32,33)(H2,23,25,30,34)/t6-,10-,11+,12+,13+,14-,15+,16-/m0/s1 |
| InChIKey | NVRDDWVSOKPQFQ-CURYJTESSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomyces (ncbitaxon:1883) | - | PubMed (2722685) |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Nikkomycin pseudo-Z (CHEBI:221827) is a peptide (CHEBI:16670) |
| IUPAC Name |
|---|
| (2R)-2-[[(2S,3S,4R)-2-amino-4-hydroxy-4-(5-hydroxypyridin-2-yl)-3-methylbutanoyl]amino]-2-[(2S,3S,4R,5R)-5-(2,4-dioxo-1H-pyrimidin-5-yl)-3,4-dihydroxyoxolan-2-yl]acetic acid |
| Manual Xrefs | Databases |
|---|---|
| 78442958 | ChemSpider |