| CAS Number | 1128181-25-8 |
| Catalog Number | AG00HCFT(AGN-PC-0WBOKO) |
| Chemical Name | Nalpha-Fmoc-Nepsilon-Stearoyl-L-Lysine |
| IUPAC Name | (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-6-(octadecanoylamino)hexanoic acid |
| InChI | InChI=1S/C39H58N2O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-28-37(42)40-29-22-21-27-36(38(43)44)41-39(45)46-30-35-33-25-19-17-23-31(33)32-24-18-20-26-34(32)35/h17-20,23-26,35-36H,2-16,21-22,27-30H2,1H3,(H,40,42)(H,41,45)(H,43,44)/t36-/m0/s1 |
| InChI Key | URNSYNGKOXMMAW-BHVANESWSA-N |
| MDL Number | MFCD22989439 |
| Molecular Formula | C39H58N2O5 |
| Molecular Weight | 634.8882 |
| SMILES | CCCCCCCCCCCCCCCCCC(=O)NCCCCC(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13 |
| Synonyms | 1128181-25-8,
Fmoc-l-lys(stea)-oh,
SCHEMBL17747033,
MFCD22989439,
ZINC59183211,
AKOS030212557,
Nalpha-Fmoc-Nepsilon-Stearoyl-L-Lysine,
N-alpha-Fmoc-N-epsilon-stearoyl-L-lysine,
|
| Complexity | 828 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 634.435g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 46 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 634.902g/mol |
| Monoisotopic Mass | 634.435g/mol |
| Rotatable Bond Count | 26 |
| Topological Polar Surface Area | 105A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 11.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number