0MG
Summary
| Name: | amino{[(4S)-4-amino-5-carboxy-5-oxopentyl]amino}methaniminium |
| Formula: | C7 H15 N4 O3 |
| Formal charge: | 1 |
| Formula weight: | 203.219 Da |
| Component type: | peptide-like |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | amino{[(4S)-4-amino-5-carboxy-5-oxopentyl]amino}methaniminium |
| OpenEye OEToolkits | 1.7.0 | [azanyl-[[(4S)-4-azanyl-6-hydroxy-5,6-dioxo-hexyl]amino]methylidene]azanium |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(C(=O)O)C(N)CCCNC(=[NH2+])\N |
| SMILES_CANONICAL | CACTVS | 3.370 | N[C@@H](CCCNC(N)=[NH2+])C(=O)C(O)=O |
| SMILES | CACTVS | 3.370 | N[CH](CCCNC(N)=[NH2+])C(=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C(C[C@@H](C(=O)C(=O)O)N)CNC(=[NH2+])N |
| SMILES | OpenEye OEToolkits | 1.7.0 | C(CC(C(=O)C(=O)O)N)CNC(=[NH2+])N |
| InChI | InChI | 1.03 | InChI=1S/C7H14N4O3/c8-4(5(12)6(13)14)2-1-3-11-7(9)10/h4H,1-3,8H2,(H,13,14)(H4,9,10,11)/p+1/t4-/m0/s1 |
| InChIKey | InChI | 1.03 | AUQVKRMFIITHQU-BYPYZUCNSA-O |
