| CAS Number | 201018-13-5 |
| Catalog Number | AG00C4NB(AGN-PC-0QRU59) |
| Chemical Name | z-d-lys-obzl benzenesulfonate |
| IUPAC Name | benzenesulfonic acid;benzyl (2R)-6-amino-2-(phenylmethoxycarbonylamino)hexanoate |
| InChI | InChI=1S/C21H26N2O4.C6H6O3S/c22-14-8-7-13-19(20(24)26-15-17-9-3-1-4-10-17)23-21(25)27-16-18-11-5-2-6-12-18;7-10(8,9)6-4-2-1-3-5-6/h1-6,9-12,19H,7-8,13-16,22H2,(H,23,25);1-5H,(H,7,8,9)/t19-;/m1./s1 |
| InChI Key | ZYQPTGXDPNAHSO-FSRHSHDFSA-N |
| MDL Number | MFCD00672347 |
| Molecular Formula | C27H32N2O7S |
| Molecular Weight | 528.6172 |
| SMILES | OS(=O)(=O)c1ccccc1.NCCCC[C@H](C(=O)OCc1ccccc1)NC(=O)OCc1ccccc1 |
| Synonyms | Z-D-LYS-OBZL BENZENESULFONATE,
201018-13-5,
C21H26N2O4.C6H6O3S,
(R)-Benzyl 6-amino-2-(((benzyloxy)carbonyl)amino)hexanoate benzenesulfonate,
7890AH,
MFCD00672347,
ACM201018135,
AS-46857,
K-5876,
(R)-benzyl 6-amino-2-(benzyloxycarbonylamino)hexanoate benzenesulfonate,
Z-D-Lys-OBzl . benzenesulfonate,
|
| Complexity | 615 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 528.193g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 37 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 528.62g/mol |
| Monoisotopic Mass | 528.193g/mol |
| Rotatable Bond Count | 13 |
| Topological Polar Surface Area | 153A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number