Deoxydynemicin A
TL;DR: Deoxydynemicin A (CAS 130640-33-4) is a chemical compound with molecular formula C30H19NO8 and molecular weight 521.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(11Z)-21,28-dihydroxy-7-methoxy-5-methyl-19,26-dioxo-3-oxa-16-azaheptacyclo[15.12.0.02,4.02,8.04,15.018,27.020,25]nonacosa-1(29),6,11,17,20(25),21,23,27-octaen-9,13-diyne-6-carboxylic acid
Also Known As: Deoxydynemicin A, (11Z)-21,28-dihydroxy-7-methoxy-5-methyl-19,26-dioxo-3-oxa-16-azaheptacyclo[15.12.0.02,4.02,8.04,15.018,27.020,25]nonacosa-1(29),6,11,17,20(25),21,23,27-octaen-9,13-diyne-6-carboxylic acid, (11Z)-21,28-dihydroxy-7-methoxy-5-methyl-19,26-dioxo-3-oxa-16-azaheptacyclo(15.12.0.02,4.02,8.04,15.018,27.020,25)nonacosa-1(29),6,11,17,20(25),21,23,27-octaen-9,13-diyne-6-carboxylic acid, RefChem:131947
| Molecular Formula | C30H19NO8 |
|---|---|
| Molecular Weight | 521.11 g/mol |
| LogP | 2.4592 |
| Topological Polar Surface Area | 145.69 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 521.1111 |
| Heavy Atoms | 39 |
| Complexity | 1794.371 |
Chemical Identifiers
| CAS Number | 130640-33-4 |
|---|---|
| SMILES | CC1C(=C(C2C#C/C=C\C#CC3C14C2(O4)C5=CC(=C6C(=C5N3)C(=O)C7=C(C6=O)C=CC=C7O)O)OC)C(=O)O |
Product Overview
Deoxydynemicin A (CAS 130640-33-4), with molecular formula C30H19NO8 and molecular weight 521.11 g/mol. IUPAC: (11Z)-21,28-dihydroxy-7-methoxy-5-methyl-19,26-dioxo-3-oxa-16-azaheptacyclo[15.12.0.02,4.02,8.04,15.018,27.020,25]nonacosa-1(29),6,11,17,20(25),21,23,27-octaen-9,13-diyne-6-carboxylic acid.
Chemical Property Profile of Deoxydynemicin A
Property Insights of Deoxydynemicin A
The XLogP value of 2.4592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Deoxydynemicin A. The TPSA of 145.69 Ų indicates high polarity, suggesting Deoxydynemicin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Deoxydynemicin A has 4 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 Deoxydynemicin A?
The CAS number of Deoxydynemicin A is 130640-33-4.
What is the molecular formula of Deoxydynemicin A?
The molecular formula of Deoxydynemicin A is C30H19NO8.
What is the molecular weight of Deoxydynemicin A?
The molecular weight of Deoxydynemicin A is 521.11 g/mol.
Where can I buy Deoxydynemicin A?
You can request a quote for Deoxydynemicin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deoxydynemicin A?
Yes, KEHONG BIO provides custom synthesis services for Deoxydynemicin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.