8GL
Summary
Name: | (2S)-2-azanyl-2-oxidanyl-pentanedioic acid |
Formula: | C5 H9 N O5 |
Formal charge: | 0 |
Formula weight: | 163.129 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | (2~{S})-2-azanyl-2-oxidanyl-pentanedioic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C5H9NO5/c6-5(11,4(9)10)2-1-3(7)8/h11H,1-2,6H2,(H,7,8)(H,9,10)/t5-/m0/s1 |
InChIKey | InChI | 1.03 | GXSDWXSYZHGBBO-YFKPBYRVSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | N[C@](O)(CCC(O)=O)C(O)=O |
SMILES | CACTVS | 3.385 | N[C](O)(CCC(O)=O)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C(C[C@](C(=O)O)(N)O)C(=O)O |
SMILES | OpenEye OEToolkits | 2.0.6 | C(CC(C(=O)O)(N)O)C(=O)O |