Vineomycin A1
TL;DR: Vineomycin A1 (CAS 78164-00-8) is a chemical compound with molecular formula C49H58O18 and molecular weight 934.3623 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,4aR,12bS)-4a,8,12b-trihydroxy-9-[(2R,4R,5S,6R)-4-hydroxy-6-methyl-5-[(2S,5S,6S)-6-methyl-5-[[(2R,6S)-6-methyl-5-oxo-2H-pyran-2-yl]oxy]oxan-2-yl]oxyoxan-2-yl]-3-methyl-3-[(2S,5S,6S)-6-methyl-5-[[(2R,6S)-6-methyl-5-oxo-2H-pyran-2-yl]oxy]oxan-2-yl]oxy-2,4-dihydrobenzo[a]anthracene-1,7,12-trione
Also Known As: vineomycin a1, Vineomycin, Vineomycin A(sub 1), Antibiotic OS-4742A1, Antibiotic OS 4742 A(sub 1)
Technical Specifications
| Molecular Formula | C49H58O18 |
| Molecular Weight | 934.3623 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 249.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 9 |
| Exact Mass | 934.3623 Da |
| Heavy Atoms | 67 |
| Complexity | 2120.0 |
| SMILES | C[C@H]1[C@H](CC[C@@H](O1)O[C@@H]2[C@H](O[C@H](C[C@H]2O)C3=C(C4=C(C=C3)C(=O)C5=C(C4=O)C=C[C@]6([C@@]5(C(=O)C[C@](C6)(C)O[C@H]7CC[C@@H]([C@@H](O7)C)O[C@H]8C=CC(=O)[C@@H](O8)C)O)O)O)C)O[C@H]9C=CC(=O)[C@@H](O9)C |
| InChIKey | YHSTYYHRDFATAQ-XURVNGJNSA-N |
Chemical Property Profile of Vineomycin A1
Property Insights of Vineomycin A1
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vineomycin A1. The TPSA of 249.0 Ų indicates high polarity, suggesting Vineomycin A1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Vineomycin A1 has 4 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Vineomycin A1?
The CAS number of Vineomycin A1 is 78164-00-8.
What is the molecular formula of Vineomycin A1?
The molecular formula of Vineomycin A1 is C49H58O18.
What is the molecular weight of Vineomycin A1?
The molecular weight of Vineomycin A1 is 934.3623 g/mol.
Where can I buy Vineomycin A1?
You can request a quote for Vineomycin A1 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Vineomycin A1?
Yes, CoreyChem provides custom synthesis services for Vineomycin A1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.