| CAS Number | 198545-00-5 |
| Catalog Number | AG002BM0(AGN-PC-0WBO44) |
| Chemical Name | 10-Oxa-2,8-diaza-13-silatetradecanoic acid, 3-carboxy-13,13-dimethyl-9-oxo-, 1-(9H-fluoren-9-ylmethyl) ester, (3R)- |
| IUPAC Name | (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-6-(2-trimethylsilylethoxycarbonylamino)hexanoic acid |
| InChI | InChI=1S/C27H36N2O6Si/c1-36(2,3)17-16-34-26(32)28-15-9-8-14-24(25(30)31)29-27(33)35-18-23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h4-7,10-13,23-24H,8-9,14-18H2,1-3H3,(H,28,32)(H,29,33)(H,30,31)/t24-/m1/s1 |
| InChI Key | OPNHWQULKLODEU-XMMPIXPASA-N |
| MDL Number | MFCD01075099 |
| Molecular Formula | C27H36N2O6Si |
| Molecular Weight | 512.6700 |
| SMILES | C[Si](C)(CCOC(NCCCC[C@H](C(O)=O)NC(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O)=O)C |
| Synonyms | Fmoc-D-Lys(Teoc)-OH,
198545-00-5,
C27H36N2O6Si,
CTK8E9917,
DTXSID90679805,
6854AH,
MFCD01075099,
AKOS030212469,
ZINC169910088,
RT-012947,
N-alpha-(9-Fluorenylmethyloxycarbonyl)-N-epsilon-(2-trimethylsilyl)ethoxycarbonyl-D-lysine,
10-Oxa-2,8-diaza-13-silatetradecanoic acid, 3-carboxy-13,13-dimethyl-9-oxo-, 1-(9H-fluoren-9-ylmethyl) ester, (3R)-,
N~2~-{[(9H-Fluoren-9-yl)methoxy]carbonyl}-N~6~-{[2-(trimethylsilyl)ethoxy]carbonyl}-D-lysine,
122903-68-8,
|
| Complexity | 720 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 512.234g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 36 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 512.678g/mol |
| Monoisotopic Mass | 512.234g/mol |
| Rotatable Bond Count | 14 |
| Topological Polar Surface Area | 114A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number