PRD_000670
Summary
| Name: | CBZ-GLU-VAL-azaASP-(S,S)EP-CO-NHCH2CH2Ph |
| Formula: | C32 H42 N5 O11 |
| Fomular weight: | 672.703 |
| Component type: | peptide-like |
| Polymer sequences: | PHQ, GLU, VAL, MY0, PEA |
| Non-polymer components: | |
| BIRD class: | Enzyme inhibitor |
| Represented as: | polymer |
| Families: | FAM_001028 |
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | [(2~{S})-4-[2-hydroxy-2-oxoethyl-[[(2~{S})-3-methyl-2-[[(2~{S})-5-oxidanyl-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoyl]amino]butanoyl]amino]amino]-2-oxidanyl-4-oxidanylidene-butanoyl]-(2-phenylethyl)azanium |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)OCc1ccccc1)C(=O)NN(CC(O)=O)C(=O)C[C@H](O)C(=O)[NH2+]CCc2ccccc2 |
| SMILES | CACTVS | 3.385 | CC(C)[CH](NC(=O)[CH](CCC(O)=O)NC(=O)OCc1ccccc1)C(=O)NN(CC(O)=O)C(=O)C[CH](O)C(=O)[NH2+]CCc2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)[C@@H](C(=O)NN(CC(=O)O)C(=O)C[C@@H](C(=O)[NH2+]CCc1ccccc1)O)NC(=O)[C@H](CCC(=O)O)NC(=O)OCc2ccccc2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)C(C(=O)NN(CC(=O)O)C(=O)CC(C(=O)[NH2+]CCc1ccccc1)O)NC(=O)C(CCC(=O)O)NC(=O)OCc2ccccc2 |
