octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol
TL;DR: octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol (CAS 138531-93-8) is a chemical compound with molecular formula C52H95N11O12 and molecular weight 1065.7162 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[1-[[2-[[1-[[1-[[2-[[2-[[1-[[1-[[2-[[1-[(1-hydroxy-4-methylpentan-2-yl)amino]-3-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-2-methyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-methyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-2-methyl-1-oxopropan-2-yl]octanamide
Also Known As: Trichogin A IV, Trichogen A IV, Trichogin A-IV, NCI60_040497, N-[1-[[2-[[1-[[1-[[2-[[2-[[1-[[1-[[2-[[1-[(1-hydroxy-4-methylpentan-2-yl)amino]-3-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-2-methyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-methyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-2-methyl-1-oxopropan-2-yl]octanamide
Technical Specifications
| Molecular Formula | C52H95N11O12 |
| Molecular Weight | 1065.7162 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 340.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 36 |
| Exact Mass | 1065.7162 Da |
| Heavy Atoms | 75 |
| Complexity | 1920.0 |
| SMILES | CCCCCCCC(=O)NC(C)(C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)NCC(=O)NCC(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)NCC(=O)NC(C(C)CC)C(=O)NC(CC(C)C)CO |
| InChIKey | LZAAXJCEERCDPT-UHFFFAOYSA-N |
Chemical Property Profile of octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol
Property Insights of octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol
The XLogP value of 4.0 indicates that octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 340.0 Ų indicates high polarity, suggesting octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol has 12 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol?
The CAS number of octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol is 138531-93-8.
What is the molecular formula of octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol?
The molecular formula of octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol is C52H95N11O12.
What is the molecular weight of octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol?
The molecular weight of octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol is 1065.7162 g/mol.
Where can I buy octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol?
You can request a quote for octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol?
Yes, CoreyChem provides custom synthesis services for octanoyl-Aib-Gly-DL-Leu-Aib-Gly-Gly-DL-Leu-Aib-Gly-DL-xiIle-DL-Leu-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.