FL6
Summary
Name: | (2S)-2-azanyl-4-methoxy-4-oxidanylidene-butanoic acid |
Formula: | C5 H9 N O4 |
Formal charge: | 0 |
Formula weight: | 147.129 Da |
Component type: | L-peptide linking |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | (2~{S})-2-azanyl-4-methoxy-4-oxidanylidene-butanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C5H9NO4/c1-10-4(7)2-3(6)5(8)9/h3H,2,6H2,1H3,(H,8,9)/t3-/m0/s1 |
InChIKey | InChI | 1.03 | SBRYFUVVWOMLLP-VKHMYHEASA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)C[C@H](N)C(O)=O |
SMILES | CACTVS | 3.385 | COC(=O)C[CH](N)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COC(=O)C[C@@H](C(=O)O)N |
SMILES | OpenEye OEToolkits | 2.0.7 | COC(=O)CC(C(=O)O)N |