(+)-Stegnane
TL;DR: (+)-Stegnane (CAS 80279-97-6) is a chemical compound with molecular formula C22H22O7 and molecular weight 398.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-trimethoxy-11,18,20-trioxapentacyclo[13.7.0.02,7.09,13.017,21]docosa-1(22),2,4,6,15,17(21)-hexaen-10-one
Also Known As: Stegane, (+)-Stegnane, (-)-Isostegnane, (.+-.)-Stegnane, (.+-.)-Isostegnane
| Molecular Formula | C22H22O7 |
|---|---|
| Molecular Weight | 398.14 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 72.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 398.13657 |
| Heavy Atoms | 29 |
| Complexity | 612.0 |
Chemical Identifiers
| CAS Number | 80279-97-6 |
|---|---|
| SMILES | COC1=C(C(=C2C(=C1)CC3C(CC4=CC5=C(C=C42)OCO5)COC3=O)OC)OC |
| InChIKey | YIIRKVZAEAXDAD-UHFFFAOYSA-N |
Product Overview
(+)-Stegnane (CAS 80279-97-6), with molecular formula C22H22O7 and molecular weight 398.14 g/mol. IUPAC: 3,4,5-trimethoxy-11,18,20-trioxapentacyclo[13.7.0.02,7.09,13.017,21]docosa-1(22),2,4,6,15,17(21)-hexaen-10-one.
Chemical Property Profile of (+)-Stegnane
Property Insights of (+)-Stegnane
The XLogP value of 3.5 indicates that (+)-Stegnane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (+)-Stegnane. Following Lipinski's Rule of Five, (+)-Stegnane has 0 hydrogen bond donor(s) and 7 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 (+)-Stegnane?
The CAS number of (+)-Stegnane is 80279-97-6.
What is the molecular formula of (+)-Stegnane?
The molecular formula of (+)-Stegnane is C22H22O7.
What is the molecular weight of (+)-Stegnane?
The molecular weight of (+)-Stegnane is 398.14 g/mol.
Where can I buy (+)-Stegnane?
You can request a quote for (+)-Stegnane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+)-Stegnane?
Yes, KEHONG BIO provides custom synthesis services for (+)-Stegnane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.