863918-60-9
Product Name:
1-ALPHA-O-BENZYL-N-ACETYLMURAMYL-ALA-D-ISOGLN-LYS(TRANS(M-NITROCINNAMOYL)-NH2)-NH2
Formula:
C41H56N8O14
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COMPUTED DESCRIPTORS
| Molecular Weight | 884.9 g/mol |
|---|---|
| XLogP3 | -0.7 |
| Hydrogen Bond Donor Count | 9 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 24 |
| Exact Mass | 884.39159849 g/mol |
| Monoisotopic Mass | 884.39159849 g/mol |
| Topological Polar Surface Area | 346 Ų |
| Heavy Atom Count | 63 |
| Formal Charge | 0 |
| Complexity | 1590 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 9 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |