EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C12H20N2O5 |
| Net Charge | 0 |
| Average Mass | 272.301 |
| Monoisotopic Mass | 272.13722 |
| SMILES | CC(C)NC(=O)N[C@H]1C=C[C@H](CC(=O)O)O[C@H]1CO |
| InChI | InChI=1S/C12H20N2O5/c1-7(2)13-12(18)14-9-4-3-8(5-11(16)17)19-10(9)6-15/h3-4,7-10,15H,5-6H2,1-2H3,(H,16,17)(H2,13,14,18)/t8-,9+,10+/m1/s1 |
| InChIKey | YHTHTGTWYCQHDQ-UTLUCORTSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[(2R,3S,6S)-2-(hydroxymethyl)-3-[[oxo-(propan-2-ylamino)methyl]amino]-3,6-dihydro-2H-pyran-6-yl]acetic acid (CHEBI:118439) is a pyrans (CHEBI:26407) |
| Manual Xrefs | Databases |
|---|---|
| LSM-29888 | LINCS |