Leucinostatin K
TL;DR: Leucinostatin K (CAS 109539-57-3) is a chemical compound with molecular formula C62H111N11O14 and molecular weight 1233.83 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-[[1-[[1-[[1-[[1-[[1-[[1-[[3-(5-aminooxypentan-2-ylamino)-3-oxopropyl]amino]-2-methyl-1-oxopropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-3-hydroxy-4-methyl-1-oxopentan-2-yl]amino]-6-hydroxy-4-methyl-1,8-dioxodecan-2-yl]-4-methyl-1-[(E,4R)-4-methylhex-2-enoyl]pyrrolidine-2-carboxamide
Also Known As: Leucinostatin K, Paecilotoxin K, Leucinostatin A, N9-oxide, Leucinostatin A, N9-Oxide ; Paecilotoxin K M-H2O+H, N-[1-[[1-[[1-[[1-[[1-[[1-[[1-[[3-(5-aminooxypentan-2-ylamino)-3-oxopropyl]amino]-2-methyl-1-oxopropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-3-hydroxy-4-methyl-1-oxopentan-2-yl]amino]-6-hydroxy-4-methyl-1,8-dioxodecan-2-yl]-4-methyl-1-[(E,4R)-4-methylhex-2-enoyl]pyrrolidine-2-carboxamide
| Molecular Formula | C62H111N11O14 |
|---|---|
| Molecular Weight | 1233.83 g/mol |
| LogP | 2.3863 |
| Topological Polar Surface Area | 374.99 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 39 |
| Exact Mass | 1233.8312 |
| Heavy Atoms | 87 |
| Complexity | 2342.014 |
Chemical Identifiers
| CAS Number | 109539-57-3 |
|---|---|
| SMILES | CC[C@@H](C)/C=C/C(=O)N1CC(CC1C(=O)NC(CC(C)CC(CC(=O)CC)O)C(=O)NC(C(C(C)C)O)C(=O)NC(C)(C)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NCCC(=O)NC(C)CCCON)C |
Product Overview
Leucinostatin K (CAS 109539-57-3), with molecular formula C62H111N11O14 and molecular weight 1233.83 g/mol. IUPAC: N-[1-[[1-[[1-[[1-[[1-[[1-[[1-[[3-(5-aminooxypentan-2-ylamino)-3-oxopropyl]amino]-2-methyl-1-oxopropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-3-hydroxy-4-methyl-1-oxopentan-2-yl]amino]-6-hydroxy-4-methyl-1,8-dioxodecan-2-yl]-4-methyl-1-[(E,4R)-4-methylhex-2-enoyl]pyrrolidine-2-carboxamide.
Chemical Property Profile of Leucinostatin K
Property Insights of Leucinostatin K
The XLogP value of 2.3863 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Leucinostatin K. The TPSA of 374.99 Ų indicates high polarity, suggesting Leucinostatin K may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Leucinostatin K has 12 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Leucinostatin K?
The CAS number of Leucinostatin K is 109539-57-3.
What is the molecular formula of Leucinostatin K?
The molecular formula of Leucinostatin K is C62H111N11O14.
What is the molecular weight of Leucinostatin K?
The molecular weight of Leucinostatin K is 1233.83 g/mol.
Where can I buy Leucinostatin K?
You can request a quote for Leucinostatin K directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Leucinostatin K?
Yes, KEHONG BIO provides custom synthesis services for Leucinostatin K and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.