asperdiol acetate
TL;DR: asperdiol acetate (CAS 198494-48-3) is a chemical compound with molecular formula C22H34O4 and molecular weight 362.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,4E,6S,7R,10E,14S)-6-hydroxy-10,14-dimethyl-7-prop-1-en-2-yl-15-oxabicyclo[12.1.0]pentadeca-4,10-dien-4-yl]methyl acetate
Also Known As: asperdiol acetate, 15-Oxabicyclo(12.1.0)pentadeca-4,10-diene-4-methanol, 6-hydroxy-10,14-dimethyl-7-(1-methylethenyl)-, 4-acetate, (1S,4E,6S,7R,10E,14S)-, [(1S,4E,6S,7R,10E,14S)-6-hydroxy-10,14-dimethyl-7-prop-1-en-2-yl-15-oxabicyclo[12.1.0]pentadeca-4,10-dien-4-yl]methyl acetate
| Molecular Formula | C22H34O4 |
|---|---|
| Molecular Weight | 362.25 g/mol |
| LogP | 4.4871 |
| Topological Polar Surface Area | 59.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.2457 |
| Heavy Atoms | 26 |
| Complexity | 588.94965 |
Chemical Identifiers
| CAS Number | 198494-48-3 |
|---|---|
| SMILES | C/C/1=C\CC[C@]2([C@@H](O2)CC/C(=C\[C@@H]([C@H](CC1)C(=C)C)O)/COC(=O)C)C |
Product Overview
asperdiol acetate (CAS 198494-48-3), with molecular formula C22H34O4 and molecular weight 362.25 g/mol. IUPAC: [(1S,4E,6S,7R,10E,14S)-6-hydroxy-10,14-dimethyl-7-prop-1-en-2-yl-15-oxabicyclo[12.1.0]pentadeca-4,10-dien-4-yl]methyl acetate.
Chemical Property Profile of asperdiol acetate
Property Insights of asperdiol acetate
The XLogP value of 4.4871 indicates that asperdiol acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.06 Ų, asperdiol acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, asperdiol acetate has 1 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 asperdiol acetate?
The CAS number of asperdiol acetate is 198494-48-3.
What is the molecular formula of asperdiol acetate?
The molecular formula of asperdiol acetate is C22H34O4.
What is the molecular weight of asperdiol acetate?
The molecular weight of asperdiol acetate is 362.25 g/mol.
Where can I buy asperdiol acetate?
You can request a quote for asperdiol acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for asperdiol acetate?
Yes, KEHONG BIO provides custom synthesis services for asperdiol acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.