| CAS Number | 1193642-32-8 |
| Catalog Number | AG00HF0F(AGN-PC-0WR3SM) |
| Chemical Name | Aloc-D-Lys(Fmoc)-OH |
| IUPAC Name | (2R)-6-(9H-fluoren-9-ylmethoxycarbonylamino)-2-(prop-2-enoxycarbonylamino)hexanoic acid |
| InChI | InChI=1S/C25H28N2O6/c1-2-15-32-25(31)27-22(23(28)29)13-7-8-14-26-24(30)33-16-21-19-11-5-3-9-17(19)18-10-4-6-12-20(18)21/h2-6,9-12,21-22H,1,7-8,13-16H2,(H,26,30)(H,27,31)(H,28,29)/t22-/m1/s1 |
| InChI Key | SVGIXLCPDFRQJL-JOCHJYFZSA-N |
| MDL Number | MFCD09263352 |
| Molecular Formula | C25H28N2O6 |
| Molecular Weight | 452.4996 |
| SMILES | C1=CC=CC=2C3=CC=CC=C3C(C12)COC(=O)NCCCC[C@@H](NC(=O)OCC=C)C(=O)O |
| Synonyms | 1193642-32-8,
Aloc-d-lys(fmoc)-oh,
MFCD09263352,
AKOS030212057,
ZINC104840479,
N-alpha-Allyloxycarbonyl-N-epsilon-(9-fluorenylmethyloxycarbonyl)-D-lysine,
D-Lysine, N6-[(9H-fluoren-9-ylmethoxy)carbonyl]-N2-[(2-propen-1-yloxy)carbonyl]-,
|
| Complexity | 662 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 452.195g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 33 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 452.507g/mol |
| Monoisotopic Mass | 452.195g/mol |
| Rotatable Bond Count | 13 |
| Topological Polar Surface Area | 114A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
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Certificate of Analysis
Lot Number