A1EBP
Summary
| Name: | (3~{S},8~{a}~{S})-3-(2-methylpropyl)-2,3,6,7,8,8~{a}-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione |
| Synonyms: | Cyclo(L-Leu-L-Pro) |
| Formula: | C11 H18 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 210.273 Da |
| Component type: | peptide-like |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (3~{S},8~{a}~{S})-3-(2-methylpropyl)-2,3,6,7,8,8~{a}-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C11H18N2O2/c1-7(2)6-8-11(15)13-5-3-4-9(13)10(14)12-8/h7-9H,3-6H2,1-2H3,(H,12,14)/t8-,9-/m0/s1 |
| InChIKey | InChI | 1.06 | SZJNCZMRZAUNQT-IUCAKERBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C1=O |
| SMILES | CACTVS | 3.385 | CC(C)C[CH]1NC(=O)[CH]2CCCN2C1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)C[C@H]1C(=O)N2CCC[C@H]2C(=O)N1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)CC1C(=O)N2CCCC2C(=O)N1 |
