SUO
Summary
Name: | N~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINE |
Synonyms: | N~2~-SUCCINYLORNITHINE |
Formula: | C9 H16 N2 O5 |
Formal charge: | 0 |
Formula weight: | 232.234 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | N~2~-(3-carboxypropanoyl)-L-ornithine |
OpenEye OEToolkits | 1.5.0 | (2S)-5-amino-2-[(4-hydroxy-4-oxo-butanoyl)amino]pentanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(NC(C(=O)O)CCCN)CCC(=O)O |
SMILES_CANONICAL | CACTVS | 3.341 | NCCC[C@H](NC(=O)CCC(O)=O)C(O)=O |
SMILES | CACTVS | 3.341 | NCCC[CH](NC(=O)CCC(O)=O)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(C[C@@H](C(=O)O)NC(=O)CCC(=O)O)CN |
SMILES | OpenEye OEToolkits | 1.5.0 | C(CC(C(=O)O)NC(=O)CCC(=O)O)CN |
InChI | InChI | 1.03 | InChI=1S/C9H16N2O5/c10-5-1-2-6(9(15)16)11-7(12)3-4-8(13)14/h6H,1-5,10H2,(H,11,12)(H,13,14)(H,15,16)/t6-/m0/s1 |
InChIKey | InChI | 1.03 | VWXQFHJBQHTHMK-LURJTMIESA-N |