A1EAJ
Summary
| Name: | (~{Z},2~{S})-2-azanyl-3-methyl-pent-3-enoic acid |
| Formula: | C6 H11 N O2 |
| Formal charge: | 0 |
| Formula weight: | 129.157 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (~{Z},2~{S})-2-azanyl-3-methyl-pent-3-enoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C6H11NO2/c1-3-4(2)5(7)6(8)9/h3,5H,7H2,1-2H3,(H,8,9)/b4-3-/t5-/m0/s1 |
| InChIKey | InChI | 1.06 | WLNGAYXEECPGBD-XUELKZDXSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C\C=C(C)/[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | CC=C(C)[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C/C=C(/C)\[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC=C(C)C(C(=O)O)N |
