16-Methyloxazolomycin
TL;DR: 16-Methyloxazolomycin (CAS 202863-86-3) is a chemical compound with molecular formula C36H51N3O9 and molecular weight 669.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4Z,6Z,8E)-3-hydroxy-N-[(2E,4E,6R,7R,9S)-6-hydroxy-9-[(1R,4S,7R,8S)-8-hydroxy-1,5,7-trimethyl-3,6-dioxo-2-oxa-5-azaspiro[3.4]octan-8-yl]-9-methoxy-7-methylnona-2,4-dienyl]-2,2,4-trimethyl-10-(1,3-oxazol-5-yl)deca-4,6,8-trienamide
Also Known As: 16-Methyloxazolomycin, 16R-Methyloxazolomycin, J2.446.310I, (3R,4Z,6Z,8E)-3-Hydroxy-N-[(2E,4E,6R,7R,9S)-6-hydroxy-9-[(1R,4S,7R,8S)-8-hydroxy-1,5,7-trimethyl-3,6-dioxo-2-oxa-5-azaspiro[3.4]octan-8-yl]-9-methoxy-7-methylnona-2,4-dienyl]-2,2,4-trimethyl-10-(1,3-oxazol-5-yl)deca-4,6,8-trienamide, (3R,4Z,6Z,8E)-3-hydroxy-N-((2E,4E,6R,7R,9S)-6-hydroxy-9-((1R,4S,7R,8S)-8-hydroxy-1,5,7-trimethyl-3,6-dioxo-2-oxa-5-azaspiro(3.4)octan-8-yl)-9-methoxy-7-methylnona-2,4-dienyl)-2,2,4-trimethyl-10-(1,3-oxazol-5-yl)deca-4,6,8-trienamide
| Molecular Formula | C36H51N3O9 |
|---|---|
| Molecular Weight | 669.36 g/mol |
| LogP | 2.8169 |
| Topological Polar Surface Area | 171.66 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 16 |
| Exact Mass | 669.36255 |
| Heavy Atoms | 48 |
| Complexity | 1429.6335 |
Chemical Identifiers
| CAS Number | 202863-86-3 |
|---|---|
| SMILES | C[C@H]1C(=O)N([C@]2([C@@]1([C@H](C[C@@H](C)[C@H](/C=C/C=C/CNC(=O)C(C)(C)[C@@H](/C(=C\C=C/C=C/CC3=CN=CO3)/C)O)O)OC)O)[C@H](OC2=O)C)C |
Product Overview
16-Methyloxazolomycin (CAS 202863-86-3), with molecular formula C36H51N3O9 and molecular weight 669.36 g/mol. IUPAC: (3R,4Z,6Z,8E)-3-hydroxy-N-[(2E,4E,6R,7R,9S)-6-hydroxy-9-[(1R,4S,7R,8S)-8-hydroxy-1,5,7-trimethyl-3,6-dioxo-2-oxa-5-azaspiro[3.4]octan-8-yl]-9-methoxy-7-methylnona-2,4-dienyl]-2,2,4-trimethyl-10-(1,3-oxazol-5-yl)deca-4,6,8-trienamide.
Chemical Property Profile of 16-Methyloxazolomycin
Property Insights of 16-Methyloxazolomycin
The XLogP value of 2.8169 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 16-Methyloxazolomycin. The TPSA of 171.66 Ų indicates high polarity, suggesting 16-Methyloxazolomycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 16-Methyloxazolomycin has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 16-Methyloxazolomycin?
The CAS number of 16-Methyloxazolomycin is 202863-86-3.
What is the molecular formula of 16-Methyloxazolomycin?
The molecular formula of 16-Methyloxazolomycin is C36H51N3O9.
What is the molecular weight of 16-Methyloxazolomycin?
The molecular weight of 16-Methyloxazolomycin is 669.36 g/mol.
Where can I buy 16-Methyloxazolomycin?
You can request a quote for 16-Methyloxazolomycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 16-Methyloxazolomycin?
Yes, KEHONG BIO provides custom synthesis services for 16-Methyloxazolomycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.