Destruxin C2
TL;DR: Destruxin C2 (CAS 79385-99-2) is a chemical compound with molecular formula C29H49N5O8 and molecular weight 595.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-hydroxy-2-methylpropyl)-10,11,14-trimethyl-13,16-di(propan-2-yl)-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone
Also Known As: Destruxin C2, Destruxin C, 2-L-valine-, beta-Alanine, 2,5-dihydroxy-4-methylpentanoyl-L-prolyl-L-valyl-N-methyl-L-valyl-N-methyl-L-alanyl-, (6->1)-lactone 5, 3-(3-hydroxy-2-methylpropyl)-10,11,14-trimethyl-13,16-di(propan-2-yl)-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone, 1,10-Dihydroxy-16-(3-hydroxy-2-methylpropyl)-5,8,9-trimethyl-3,6-di(propan-2-yl)-5,6,8,9,12,13,19,20,21,21a-decahydropyrrolo[1,2-d][1,4,7,10,13,16]oxapentaazacyclononadecine-4,7,14,17(3H,16H)-tetrone
| Molecular Formula | C29H49N5O8 |
|---|---|
| Molecular Weight | 595.36 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 595.3581 |
| Heavy Atoms | 42 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 79385-99-2 |
|---|---|
| SMILES | CC1C(=O)NCCC(=O)OC(C(=O)N2CCCC2C(=O)NC(C(=O)N(C(C(=O)N1C)C(C)C)C)C(C)C)CC(C)CO |
| InChIKey | BMFFTIQOTAYCMR-UHFFFAOYSA-N |
Product Overview
Destruxin C2 (CAS 79385-99-2), with molecular formula C29H49N5O8 and molecular weight 595.36 g/mol. IUPAC: 3-(3-hydroxy-2-methylpropyl)-10,11,14-trimethyl-13,16-di(propan-2-yl)-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone.
Chemical Property Profile of Destruxin C2
Property Insights of Destruxin C2
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Destruxin C2. The TPSA of 166.0 Ų indicates high polarity, suggesting Destruxin C2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Destruxin C2 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Destruxin C2?
The CAS number of Destruxin C2 is 79385-99-2.
What is the molecular formula of Destruxin C2?
The molecular formula of Destruxin C2 is C29H49N5O8.
What is the molecular weight of Destruxin C2?
The molecular weight of Destruxin C2 is 595.36 g/mol.
Where can I buy Destruxin C2?
You can request a quote for Destruxin C2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Destruxin C2?
Yes, KEHONG BIO provides custom synthesis services for Destruxin C2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.