9R4
Summary
| Name: | D-gamma-glutamyl-2-methyl-L-alanine |
| Formula: | C9 H16 N2 O5 |
| Formal charge: | 0 |
| Formula weight: | 232.234 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | D-gamma-glutamyl-2-methyl-L-alanine |
| OpenEye OEToolkits | 2.0.6 | (2~{R})-2-azanyl-5-[(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]-5-oxidanylidene-pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NC(CCC(NC(C)(C(O)=O)C)=O)C(O)=O |
| InChI | InChI | 1.03 | InChI=1S/C9H16N2O5/c1-9(2,8(15)16)11-6(12)4-3-5(10)7(13)14/h5H,3-4,10H2,1-2H3,(H,11,12)(H,13,14)(H,15,16)/t5-/m1/s1 |
| InChIKey | InChI | 1.03 | SWPZYVBHCFOANH-RXMQYKEDSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)(NC(=O)CC[C@@H](N)C(O)=O)C(O)=O |
| SMILES | CACTVS | 3.385 | CC(C)(NC(=O)CC[CH](N)C(O)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(C)(C(=O)O)NC(=O)CC[C@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(C)(C(=O)O)NC(=O)CCC(C(=O)O)N |
