TL;DR: Sialokinin II (CAS 152923-42-7) is a chemical compound with molecular formula C51H76N12O16S and molecular weight 1144.5223 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-amino-4-[[(2S,3R)-1-[[2-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-4-oxobutanoic acid
Also Known As: Sialokinin II, Asp-thr-gly-asp-lys-phe-tyr-gly-leu-met-NH2, H-Asp-Thr-Cly-Asp-Lys-Phe-Tyr-Gly-Leu-Met-NH2, (3S)-3-amino-4-[[(2S,3R)-1-[[2-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-4-oxobutanoic acid, Physalemin, 1-de(5-oxo-L-proline)-2-L-aspartic acid-3-L-threonine-4-glycine-5-L-aspartic acid-
| Molecular Formula | C51H76N12O16S |
| Molecular Weight | 1144.5223 g/mol |
| XLogP | -6.8 |
| Topological Polar Surface Area (TPSA) | 497.0 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 37 |
| Exact Mass | 1144.5223 Da |
| Heavy Atoms | 80 |
| Complexity | 2090.0 |
| SMILES | C[C@H]([C@@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)[C@H](CC(=O)O)N)O |
| InChIKey | DAASCSHCPGXAAM-FBCVKHONSA-N |
The XLogP value of -6.8 indicates that Sialokinin II is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 497.0 Ų indicates high polarity, suggesting Sialokinin II may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sialokinin II has 16 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Sialokinin II is 152923-42-7.
The molecular formula of Sialokinin II is C51H76N12O16S.
The molecular weight of Sialokinin II is 1144.5223 g/mol.
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