| CAS Number | 32326-55-9 |
| Catalog Number | AG003AH4(AGN-PC-0R7OH5) |
| Chemical Name | H-Glu(Ome)-Obzl Tos |
| IUPAC Name | 1-O-benzyl 5-O-methyl (2S)-2-aminopentanedioate;4-methylbenzenesulfonic acid |
| InChI | InChI=1S/C13H17NO4.C7H8O3S/c1-17-12(15)8-7-11(14)13(16)18-9-10-5-3-2-4-6-10;1-6-2-4-7(5-3-6)11(8,9)10/h2-6,11H,7-9,14H2,1H3;2-5H,1H3,(H,8,9,10)/t11-;/m0./s1 |
| InChI Key | DVKWXOZIOZDBJY-MERQFXBCSA-N |
| MDL Number | MFCD00190907 |
| Molecular Formula | C20H25NO7S |
| Molecular Weight | 423.4800 |
| SMILES | O=C(OCC1=CC=CC=C1)[C@@H](N)CCC(OC)=O.O=S(C2=CC=C(C)C=C2)(O)=O |
| Synonyms | 32326-55-9,
H-GLU(OME)-OBZL TOS,
H-Glu(OMe)-OBzl.TosOH,
C13H17NO4.C7H8O3S,
7147AH,
L-Glutamic acid gamma-methyl alpha-benzyl ester 4-toluenesulfonate salt,
MFCD00190907,
ACM32326559,
K-7531,
L-Glutamic acid gama-methyl alfa-benzyl ester 4-toluenesulfonate salt,
H-GLU -OBZLTOS,
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| Complexity | 481 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 423.135g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 29 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 423.48g/mol |
| Monoisotopic Mass | 423.135g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 141A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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