Alloferon 3

Chemical Information
| CAS Number | 347884-63-3 |
| PubChem CID | 10170376 |
| IUPAC Name | (2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-5-amino-2-[[2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]acetyl]amino]-5-oxopentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]acetyl]amino]-3-methylbutanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid |
| Molecular Formula | C42H63N17O13 |
| Molecular Weight | 1014.1 |
| XLogP | -7.5 |
| Topological Polar Surface Area | 475 |
| Hydrogen Bond Donor Count | 16 |
| Hydrogen Bond Acceptor Count | 17 |
| Rotatable Bond Count | 31 |
| Heavy Atom Count | 72 |
| Formal Charge | 0 |
| Complexity | 1910 |
| Property | Value |
|---|---|
| Molecular Weight | 1014.1 |
| XLogP3 | -7.5 |
| Hydrogen Bond Donor Count | 16 |
| Hydrogen Bond Acceptor Count | 17 |
| Rotatable Bond Count | 31 |
| Exact Mass | 1013.47912513 |
| Monoisotopic Mass | 1013.47912513 |
| Topological Polar Surface Area | 475 Ų |
| Heavy Atom Count | 72 |
| Formal Charge | 0 |
| Complexity | 1910 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 7 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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