EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C20H24ClN5O4 |
| Net Charge | 0 |
| Average Mass | 433.896 |
| Monoisotopic Mass | 433.15168 |
| SMILES | O=C(NCC[C@@H]1CC[C@@H](NC(=O)c2cnccn2)[C@@H](CO)O1)Nc1ccc(Cl)cc1 |
| InChI | InChI=1S/C20H24ClN5O4/c21-13-1-3-14(4-2-13)25-20(29)24-8-7-15-5-6-16(18(12-27)30-15)26-19(28)17-11-22-9-10-23-17/h1-4,9-11,15-16,18,27H,5-8,12H2,(H,26,28)(H2,24,25,29)/t15-,16+,18+/m0/s1 |
| InChIKey | OWGSILQKVGHWMO-LZLYRXPVSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2S,3R,6S)-6-[2-[[(4-chloroanilino)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide (CHEBI:118510) is a C-glycosyl compound (CHEBI:20857) |
| Manual Xrefs | Databases |
|---|---|
| LSM-29959 | LINCS |