Virginiamycin butanolide B
TL;DR: Virginiamycin butanolide B (CAS 109075-61-8) is a chemical compound with molecular formula C12H22O4 and molecular weight 230.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one
Also Known As: Virginiamycin butanolide B, Virginiae butanolide B, 4-(hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one, 2-(1'-Hydroxy-4'-methylhexyl)-3-(hydroxymethyl)butanolide, 3-(1-HYDROXY-4-METHYLHEXYL)-4-(HYDROXYMETHYL)OXOLAN-2-ONE
| Molecular Formula | C12H22O4 |
|---|---|
| Molecular Weight | 230.15 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 230.15181 |
| Heavy Atoms | 16 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 109075-61-8 |
|---|---|
| SMILES | CCC(C)CCC(C1C(COC1=O)CO)O |
| InChIKey | LOMGRMLVVBQVNJ-UHFFFAOYSA-N |
Product Overview
Virginiamycin butanolide B (CAS 109075-61-8), with molecular formula C12H22O4 and molecular weight 230.15 g/mol. IUPAC: 4-(hydroxymethyl)-3-(1-hydroxy-4-methylhexyl)oxolan-2-one.
Chemical Property Profile of Virginiamycin butanolide B
Property Insights of Virginiamycin butanolide B
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Virginiamycin butanolide B. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Virginiamycin butanolide B. Following Lipinski's Rule of Five, Virginiamycin butanolide B has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Virginiamycin butanolide B?
The CAS number of Virginiamycin butanolide B is 109075-61-8.
What is the molecular formula of Virginiamycin butanolide B?
The molecular formula of Virginiamycin butanolide B is C12H22O4.
What is the molecular weight of Virginiamycin butanolide B?
The molecular weight of Virginiamycin butanolide B is 230.15 g/mol.
Where can I buy Virginiamycin butanolide B?
You can request a quote for Virginiamycin butanolide B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Virginiamycin butanolide B?
Yes, KEHONG BIO provides custom synthesis services for Virginiamycin butanolide B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.