ILO
Summary
Name: | N5-IMINOETHYL-L-ORNITHINE |
Formula: | C7 H15 N3 O2 |
Formal charge: | 0 |
Formula weight: | 173.213 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | N~5~-[(1E)-ethanimidoyl]-L-ornithine |
OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-5-(ethanimidoylamino)pentanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)C(N)CCCNC(=[N@H])C |
SMILES_CANONICAL | CACTVS | 3.341 | CC(=N)NCCC[C@H](N)C(O)=O |
SMILES | CACTVS | 3.341 | CC(=N)NCCC[CH](N)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(=N)NCCC[C@@H](C(=O)O)N |
SMILES | OpenEye OEToolkits | 1.5.0 | CC(=N)NCCCC(C(=O)O)N |
InChI | InChI | 1.03 | InChI=1S/C7H15N3O2/c1-5(8)10-4-2-3-6(9)7(11)12/h6H,2-4,9H2,1H3,(H2,8,10)(H,11,12)/t6-/m0/s1 |
InChIKey | InChI | 1.03 | UYZFAUAYFLEHRC-LURJTMIESA-N |