| CAS Number | 157974-36-2 |
| Catalog Number | AG01E2F2(AGN-PC-0WP0I0) |
| Chemical Name | N6-[2-(2-Furanyl)-2-oxoethyl]-L-lysineDihydrochloride |
| IUPAC Name | 2-amino-6-[[2-(furan-2-yl)-2-oxoethyl]amino]hexanoic acid;dihydrochloride |
| InChI | InChI=1S/C12H18N2O4.2ClH/c13-9(12(16)17)4-1-2-6-14-8-10(15)11-5-3-7-18-11;;/h3,5,7,9,14H,1-2,4,6,8,13H2,(H,16,17);2*1H |
| InChI Key | HRTZJJIVKJREPV-UHFFFAOYSA-N |
| MDL Number | MFCD11857850 |
| Molecular Formula | C12H20Cl2N2O4 |
| Molecular Weight | 327.2042 |
| SMILES | O=C(C1=CC=CO1)CNCCCC[C@H](N)C(O)=O.Cl.Cl |
| Synonyms | N6-[2-(2-Furanyl)-2-oxoethyl]-L-lysine dihydrochloride,
157974-36-2,
|
| Complexity | 283 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 326.080013g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 5 |
| Isotope Atom Count | 0 |
| Molecular Weight | 327.2g/mol |
| Monoisotopic Mass | 326.080013g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 106Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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