莫西菌素
TL;DR: 莫西菌素 (CAS 113507-06-5) is a chemical compound with molecular formula C37H53NO8 and molecular weight 639.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
莫西菌素
(1R,4S,4'Z,5'S,6R,8R,10E,13R,14E,16E,20R,21R,24S)-21,24-dihydroxy-4'-methoxyimino-5',11,13,22-tetramethyl-6'-[(E)-4-methylpent-2-en-2-yl]spiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one
Also Known As: Moxidectin, 5-hydroxymilbemycin beta7, EX-A496, (1R,4S,4'Z,5'S,6R,8R,10E,13R,14E,16E,20R,21R,24S)-21,24-Dihydroxy-4'-methoxyimino-5',11,13,22-tetramethyl-6'-[(E)-4-methylpent-2-en-2-yl]spiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one
| Molecular Formula | C37H53NO8 |
|---|---|
| Molecular Weight | 639.38 g/mol |
| LogP | 5.7289 |
| Topological Polar Surface Area | 116.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 639.37714 |
| Heavy Atoms | 46 |
| Complexity | 1342.2928 |
Chemical Identifiers
| CAS Number | 113507-06-5 |
|---|---|
| SMILES | C[C@@H]\1C/C(=C/C[C@@H]2C[C@@H](C[C@@]3(O2)C/C(=N/OC)/[C@@H](C(O3)/C(=C/C(C)C)/C)C)OC(=O)[C@@H]4C=C([C@H]([C@@H]5[C@]4(/C(=C/C=C1)/CO5)O)O)C)/C |
Product Overview
莫西菌素 (CAS 113507-06-5), with molecular formula C37H53NO8 and molecular weight 639.38 g/mol. IUPAC: (1R,4S,4'Z,5'S,6R,8R,10E,13R,14E,16E,20R,21R,24S)-21,24-dihydroxy-4'-methoxyimino-5',11,13,22-tetramethyl-6'-[(E)-4-methylpent-2-en-2-yl]spiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one.
Chemical Property Profile of 莫西菌素
Property Insights of 莫西菌素
The XLogP value of 5.7289 indicates that 莫西菌素 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 莫西菌素. Following Lipinski's Rule of Five, 莫西菌素 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 莫西菌素?
The CAS number of 莫西菌素 is 113507-06-5.
What is the molecular formula of 莫西菌素?
The molecular formula of 莫西菌素 is C37H53NO8.
What is the molecular weight of 莫西菌素?
The molecular weight of 莫西菌素 is 639.38 g/mol.
Where can I buy 莫西菌素?
You can request a quote for 莫西菌素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 莫西菌素?
Yes, KEHONG BIO provides custom synthesis services for 莫西菌素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.