Destruxin A
TL;DR: Destruxin A (CAS 6686-70-0) is a chemical compound with molecular formula C29H47N5O7 and molecular weight 577.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-butan-2-yl-10,11,14-trimethyl-13-propan-2-yl-3-prop-2-enyl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone
Also Known As: Destruxin A, MEGxm0_000391, ACon0_000641, ACon1_001603, BRD-A23078753-001-01-3
| Molecular Formula | C29H47N5O7 |
|---|---|
| Molecular Weight | 577.35 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 577.34753 |
| Heavy Atoms | 41 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 6686-70-0 |
|---|---|
| SMILES | CCC(C)C1C(=O)N(C(C(=O)N(C(C(=O)NCCC(=O)OC(C(=O)N2CCCC2C(=O)N1)CC=C)C)C)C(C)C)C |
| InChIKey | XIYSEKITPHTMJT-UHFFFAOYSA-N |
Product Overview
Destruxin A (CAS 6686-70-0), with molecular formula C29H47N5O7 and molecular weight 577.35 g/mol. IUPAC: 16-butan-2-yl-10,11,14-trimethyl-13-propan-2-yl-3-prop-2-enyl-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone.
Chemical Property Profile of Destruxin A
Property Insights of Destruxin A
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Destruxin A. The TPSA of 145.0 Ų indicates high polarity, suggesting Destruxin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Destruxin A has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Destruxin A?
The CAS number of Destruxin A is 6686-70-0.
What is the molecular formula of Destruxin A?
The molecular formula of Destruxin A is C29H47N5O7.
What is the molecular weight of Destruxin A?
The molecular weight of Destruxin A is 577.35 g/mol.
Where can I buy Destruxin A?
You can request a quote for Destruxin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Destruxin A?
Yes, KEHONG BIO provides custom synthesis services for Destruxin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.