TL;DR: (D-Ala2)Deltorphin I (CAS 122752-15-2) is a chemical compound with molecular formula C37H52N8O10 and molecular weight 768.3806 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-[[(2S)-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-phenylpropanoyl]amino]-4-[[1-[[(2S)-1-[(2-amino-2-oxoethyl)amino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid
Also Known As: Deltorphin C, Deltorphin I, Delt-I, (Ala(2))deltorphin I, (D-Ala2)Deltorphin I
| Molecular Formula | C37H52N8O10 |
| Molecular Weight | 768.3806 g/mol |
| XLogP | -1.7 |
| Topological Polar Surface Area (TPSA) | 301.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 21 |
| Exact Mass | 768.3806 Da |
| Heavy Atoms | 55 |
| Complexity | 1350.0 |
| SMILES | C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(=O)O)C(=O)NC(C(C)C)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N)NC(=O)[C@H](CC2=CC=C(C=C2)O)N |
| InChIKey | CJAORFIPPWIGPG-OBUNQCGMSA-N |
The XLogP value of -1.7 indicates that (D-Ala2)Deltorphin I is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 301.0 Ų indicates high polarity, suggesting (D-Ala2)Deltorphin I may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (D-Ala2)Deltorphin I has 10 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (D-Ala2)Deltorphin I is 122752-15-2.
The molecular formula of (D-Ala2)Deltorphin I is C37H52N8O10.
The molecular weight of (D-Ala2)Deltorphin I is 768.3806 g/mol.
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