| CAS Number | 1310680-26-2 |
| Catalog Number | AG00HSCL(AGN-PC-0WBO6W) |
| Chemical Name | (R)-Fmoc-4-amino-heptanedioic acid-1-tert-butyl ester |
| IUPAC Name | (4R)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-[(2-methylpropan-2-yl)oxy]-7-oxoheptanoic acid |
| InChI | InChI=1S/C26H31NO6/c1-26(2,3)33-24(30)15-13-17(12-14-23(28)29)27-25(31)32-16-22-20-10-6-4-8-18(20)19-9-5-7-11-21(19)22/h4-11,17,22H,12-16H2,1-3H3,(H,27,31)(H,28,29)/t17-/m1/s1 |
| InChI Key | LTFVVSHYJGOEEM-QGZVFWFLSA-N |
| MDL Number | MFCD05663763 |
| Molecular Formula | C26H31NO6 |
| Molecular Weight | 453.5274 |
| SMILES | OC(=O)CC[C@@H](NC(=O)OCC1c2ccccc2-c2c1cccc2)CCC(=O)OC(C)(C)C |
| Synonyms | 1310680-26-2,
SCHEMBL16061957,
MFCD05663763,
ZINC39778392,
A-7789,
Fmoc-(R)-4-Aminopimelic acid 1-t-butyl ester,
Fmoc-(R)-4-aminopimelic acid 1-tert-butyl ester,
(R)-Fmoc-4-amino-heptanedioic acid-1-tert-butyl ester,
|
| Complexity | 665 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 453.215g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 33 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 453.535g/mol |
| Monoisotopic Mass | 453.215g/mol |
| Rotatable Bond Count | 12 |
| Topological Polar Surface Area | 102A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number