TL;DR: Jmv 332 (CAS 130582-12-6) is a chemical compound with molecular formula C44H58N10O11 and molecular weight 902.42865 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-acetamido-6-[[(Z)-4-oxobut-2-enoyl]amino]hexanoyl]amino]acetyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-6-aminohexanoyl]amino]-4-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid
Also Known As: Jmv 332, (3S)-3-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-acetamido-6-[[(Z)-4-oxobut-2-enoyl]amino]hexanoyl]amino]acetyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-6-aminohexanoyl]amino]-4-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid, L-Phenylalaninamide, N2-acetyl-N6-(3-carboxy-1-oxopropyl)-L-lysylglycyl-L-tryptophyl-L-lysyl-L-alpha-aspartyl-, cyclic (1-4)-peptide, (3S,6S,9S,15S,Z)-9-((1H-indol-3-yl)methyl)-15-acetamido-3-(((S)-1-amino-1-oxo-3-phenylpropan-2-yl)carbamoyl)-6-(4-aminobutyl)-5,8,11,14,21,24-hexaoxo-4,7,10,13,20-pentaazatetracos-22-enoic acid
| Molecular Formula | C44H58N10O11 |
| Molecular Weight | 902.42865 g/mol |
| XLogP | -3.4 |
| Topological Polar Surface Area (TPSA) | 343.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 29 |
| Exact Mass | 902.42865 Da |
| Heavy Atoms | 65 |
| Complexity | 1670.0 |
| SMILES | CC(=O)N[C@@H](CCCCNC(=O)/C=C\C=O)C(=O)NCC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N |
| InChIKey | ZMIFULRIGOBNGJ-ZTDUOXEXSA-N |
The XLogP value of -3.4 indicates that Jmv 332 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 343.0 Ų indicates high polarity, suggesting Jmv 332 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Jmv 332 has 11 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Jmv 332 is 130582-12-6.
The molecular formula of Jmv 332 is C44H58N10O11.
The molecular weight of Jmv 332 is 902.42865 g/mol.
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