HYA
Summary
| Name: | 2,3,4,N-TETRAHYDROXY-BUTYRIMIDIC ACID |
| Formula: | C4 H9 N O5 |
| Formal charge: | 0 |
| Formula weight: | 151.118 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (1Z,2S,3R)-N,2,3,4-tetrahydroxybutanimidic acid |
| OpenEye OEToolkits | 1.5.0 | (2S,3R)-N,2,3,4-tetrahydroxybutanimidic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | N(/O)=C(/O)C(O)C(O)CO |
| SMILES_CANONICAL | CACTVS | 3.341 | OC[C@@H](O)[C@H](O)\C(O)=N\O |
| SMILES | CACTVS | 3.341 | OC[CH](O)[CH](O)C(O)=NO |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C([C@H]([C@@H](/C(=N/O)/O)O)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(C(C(C(=NO)O)O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C4H9NO5/c6-1-2(7)3(8)4(9)5-10/h2-3,6-8,10H,1H2,(H,5,9)/t2-,3+/m1/s1 |
| InChIKey | InChI | 1.03 | SJYJPXDRLWCEKB-GBXIJSLDSA-N |
