Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)-
TL;DR: Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)- (CAS 68974-62-9) is a chemical compound with molecular formula C21H30O4 and molecular weight 346.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2R,7S,9R,11R,12S,16S)-2,16-dimethyl-15-oxo-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadecan-5-yl] acetate
Also Known As: Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)-, 3-(Acetyloxy)-5,6-epoxyandrostan-17-one (5alpha,6alpha)-
| Molecular Formula | C21H30O4 |
|---|---|
| Molecular Weight | 346.21 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 55.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 346.21442 |
| Heavy Atoms | 25 |
| Complexity | 644.0 |
Chemical Identifiers
| CAS Number | 68974-62-9 |
|---|---|
| SMILES | CC(=O)OC1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3C[C@@H]5[C@@]2(C1)O5)CCC4=O)C)C |
| InChIKey | RUQCGCWODJEVJZ-HMHNEGLZSA-N |
Product Overview
Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)- (CAS 68974-62-9), with molecular formula C21H30O4 and molecular weight 346.21 g/mol. IUPAC: [(1S,2R,7S,9R,11R,12S,16S)-2,16-dimethyl-15-oxo-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadecan-5-yl] acetate.
Chemical Property Profile of Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)-
Property Insights of Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)-
The XLogP value of 3.0 indicates that Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.9 Ų, Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)- has 0 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 Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)-?
The CAS number of Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)- is 68974-62-9.
What is the molecular formula of Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)-?
The molecular formula of Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)- is C21H30O4.
What is the molecular weight of Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)-?
The molecular weight of Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)- is 346.21 g/mol.
Where can I buy Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)-?
You can request a quote for Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)-?
Yes, KEHONG BIO provides custom synthesis services for Androstan-17-one, 3-(acetyloxy)-5,6-epoxy-, (5alpha,6alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.