C30H49N7O6S2.ClH
(2S,3S)-N-[2-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-2-oxoethyl]-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-phenylpropanoyl]amino]-3-methylpentanamide;hydrochloride
Also Known As: L-Methioninamide, L-alanyl-L-phenylalanyl-L-isoleucylglycyl-L-methionyl-, monohydrochloride|L-Methioninamide, L-alanyl-L-phenylalanyl-L- isoleucylglycyl-L-methionyl-, monohydrochloride|L-alanyl-l-phenylalanyl-l-isoleucylglycyl-l-methionyl-methioninamide hydrochloride|(2S,3S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-phenyl-propanoyl]amino]-N-[2-[[(1S)-1-[[(1S)-1-carbamoyl-3-methylsulfanyl-propyl]carbamoyl]-3-methylsulfanyl-propyl]amino]-2-oxo-ethyl]-3-methyl-pentanamide hydrochloride|(2S,3S)-N-[2-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-2-oxoethyl]-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-phenylpropanoyl]amino]-3-methylpentanamide hydrochloride|L-Alanyl-L-phenylalanyl-L-isoleucylglycyl-L-methionyl-L-methioninamide--hydrogen chloride (1/1)
| Molecular Formula | C30H50ClN7O6S2 |
|---|---|
| Molecular Weight | 703.2952 g/mol |
| LogP | 0.0911 |
| Topological Polar Surface Area | 214.61 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 21 |
| Exact Mass | 703.2952 |
| Monoisotopic Mass | 703.2952 |
| Heavy Atoms | 46 |
| Complexity | 1132.2312 |
Chemical Identifiers
| CAS Number | 2807-80-9 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](C)N.Cl |
Product Overview
C30H49N7O6S2.ClH (CAS 2807-80-9), with molecular formula C30H50ClN7O6S2 and molecular weight 703.2952 g/mol. IUPAC: (2S,3S)-N-[2-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-2-oxoethyl]-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-phenylpropanoyl]amino]-3-methylpentanamide;hydrochloride.