5R5
Summary
Name: | methyl L-serinate |
Synonyms: | methyl (2~{S})-2-azanyl-3-oxidanyl-propanoate |
Formula: | C4 H9 N O3 |
Formal charge: | 0 |
Formula weight: | 119.119 Da |
Component type: | L-peptide linking |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | methyl L-serinate |
OpenEye OEToolkits | 2.0.7 | methyl (2~{S})-2-azanyl-3-oxidanyl-propanoate |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | NC(C(=O)OC)CO |
InChI | InChI | 1.03 | InChI=1S/C4H9NO3/c1-8-4(7)3(5)2-6/h3,6H,2,5H2,1H3/t3-/m0/s1 |
InChIKey | InChI | 1.03 | ANSUDRATXSJBLY-VKHMYHEASA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)[C@@H](N)CO |
SMILES | CACTVS | 3.385 | COC(=O)[CH](N)CO |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COC(=O)[C@H](CO)N |
SMILES | OpenEye OEToolkits | 2.0.7 | COC(=O)C(CO)N |