Deltamycin A3
TL;DR: Deltamycin A3 (CAS 58880-24-3) is a chemical compound with molecular formula C41H65NO16 and molecular weight 827.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-[6-[[(14E)-7-acetyloxy-8-methoxy-3,12-dimethyl-5,13-dioxo-10-(2-oxoethyl)-4,17-dioxabicyclo[14.1.0]heptadec-14-en-9-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] butanoate
Also Known As: Deltamycin A3, Leucomycin V, 9-deoxy-12,13-epoxy-12,13-dihydro-9-oxo-, 3-acetate 4(sup B)-butanoate, (12S,13S)-, [6-[6-[[(14E)-7-acetyloxy-8-methoxy-3,12-dimethyl-5,13-dioxo-10-(2-oxoethyl)-4,17-dioxabicyclo[14.1.0]heptadec-14-en-9-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] butanoate, [(2S,3S,4R,6S)-6-[(2R,3S,4R,5R,6S)-6-[[(1S,3R,7R,8S,9S,10R,12R,14E,16S)-7-acetyloxy-8-methoxy-3,12-dimethyl-5,13-dioxo-10-(2-oxoethyl)-4,17-dioxabicyclo[14.1.0]heptadec-14-en-9-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimeth, Leucomycin V,9-deoxy-12,13-epoxy-12,13-dihydro-9-oxo-,3-acetate 4(sup B)-butanoate,(12S,13S)
| Molecular Formula | C41H65NO16 |
|---|---|
| Molecular Weight | 827.43 g/mol |
| LogP | 2.1868 |
| Topological Polar Surface Area | 215.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 12 |
| Exact Mass | 827.43036 |
| Heavy Atoms | 58 |
| Complexity | 1438.0948 |
Chemical Identifiers
| CAS Number | 58880-24-3 |
|---|---|
| SMILES | CCCC(=O)OC1C(OC(CC1(C)O)OC2C(OC(C(C2N(C)C)O)OC3C(CC(C(=O)/C=C/C4C(O4)CC(OC(=O)CC(C3OC)OC(=O)C)C)C)CC=O)C)C |
Product Overview
Deltamycin A3 (CAS 58880-24-3), with molecular formula C41H65NO16 and molecular weight 827.43 g/mol. IUPAC: [6-[6-[[(14E)-7-acetyloxy-8-methoxy-3,12-dimethyl-5,13-dioxo-10-(2-oxoethyl)-4,17-dioxabicyclo[14.1.0]heptadec-14-en-9-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] butanoate.
Chemical Property Profile of Deltamycin A3
Property Insights of Deltamycin A3
The XLogP value of 2.1868 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Deltamycin A3. The TPSA of 215.42 Ų indicates high polarity, suggesting Deltamycin A3 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Deltamycin A3 has 2 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Deltamycin A3?
The CAS number of Deltamycin A3 is 58880-24-3.
What is the molecular formula of Deltamycin A3?
The molecular formula of Deltamycin A3 is C41H65NO16.
What is the molecular weight of Deltamycin A3?
The molecular weight of Deltamycin A3 is 827.43 g/mol.
Where can I buy Deltamycin A3?
You can request a quote for Deltamycin A3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deltamycin A3?
Yes, KEHONG BIO provides custom synthesis services for Deltamycin A3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.