| CAS Number | 18800-76-5 |
| Catalog Number | AG00ACGM(AGN-PC-0QH49H) |
| Chemical Name | Boc-D-Glu(OBzl)-Osu |
| IUPAC Name | 5-O-benzyl 1-O-(2,5-dioxopyrrolidin-1-yl) (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioate |
| InChI | InChI=1S/C21H26N2O8/c1-21(2,3)30-20(28)22-15(19(27)31-23-16(24)10-11-17(23)25)9-12-18(26)29-13-14-7-5-4-6-8-14/h4-8,15H,9-13H2,1-3H3,(H,22,28)/t15-/m1/s1 |
| InChI Key | XVJBCWSNHLGDLQ-OAHLLOKOSA-N |
| MDL Number | MFCD00236847 |
| Molecular Formula | C21H26N2O8 |
| Molecular Weight | 434.4397 |
| SMILES | O=C(OCc1ccccc1)CC[C@H](C(=O)ON1C(=O)CCC1=O)NC(=O)OC(C)(C)C |
| Synonyms | BOC-D-GLU(OBZL)-OSU,
18800-76-5,
6324AH,
MFCD00236847,
ZINC100239435,
K-5643,
C21H26N2O8,
Boc-D-glutamic acid r-benzyl ester a-N-hydroxysuccinimide ester,
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| Complexity | 678 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 434.169g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 31 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 434.445g/mol |
| Monoisotopic Mass | 434.169g/mol |
| Rotatable Bond Count | 12 |
| Topological Polar Surface Area | 128A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number