螺甾-5,25(27)-二烯-1,3-二醇
TL;DR: 螺甾-5,25(27)-二烯-1,3-二醇 (CAS 17676-33-4) is a chemical compound with molecular formula C27H40O4 and molecular weight 428.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
螺甾-5,25(27)-二烯-1,3-二醇
7,9,13-trimethyl-5'-methylidenespiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-14,16-diol
Also Known As: Neoruscogenin, Neoruscogenin [M+H]+, spirosta-5,25(27)-dien-1,3-diol, Spirosta-5,25(27)-diene-1beta,3beta-diol
| Molecular Formula | C27H40O4 |
|---|---|
| Molecular Weight | 428.29 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 428.29266 |
| Heavy Atoms | 31 |
| Complexity | 820.0 |
Chemical Identifiers
| CAS Number | 17676-33-4 |
|---|---|
| SMILES | CC1C2C(CC3C2(CCC4C3CC=C5C4(C(CC(C5)O)O)C)C)OC16CCC(=C)CO6 |
| InChIKey | ALTRINCJVPIQNK-UHFFFAOYSA-N |
Product Overview
螺甾-5,25(27)-二烯-1,3-二醇 (CAS 17676-33-4), with molecular formula C27H40O4 and molecular weight 428.29 g/mol. IUPAC: 7,9,13-trimethyl-5'-methylidenespiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-14,16-diol.
Chemical Property Profile of 螺甾-5,25(27)-二烯-1,3-二醇
Property Insights of 螺甾-5,25(27)-二烯-1,3-二醇
The XLogP value of 4.1 indicates that 螺甾-5,25(27)-二烯-1,3-二醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.9 Ų, 螺甾-5,25(27)-二烯-1,3-二醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 螺甾-5,25(27)-二烯-1,3-二醇 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 螺甾-5,25(27)-二烯-1,3-二醇?
The CAS number of 螺甾-5,25(27)-二烯-1,3-二醇 is 17676-33-4.
What is the molecular formula of 螺甾-5,25(27)-二烯-1,3-二醇?
The molecular formula of 螺甾-5,25(27)-二烯-1,3-二醇 is C27H40O4.
What is the molecular weight of 螺甾-5,25(27)-二烯-1,3-二醇?
The molecular weight of 螺甾-5,25(27)-二烯-1,3-二醇 is 428.29 g/mol.
Where can I buy 螺甾-5,25(27)-二烯-1,3-二醇?
You can request a quote for 螺甾-5,25(27)-二烯-1,3-二醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 螺甾-5,25(27)-二烯-1,3-二醇?
Yes, KEHONG BIO provides custom synthesis services for 螺甾-5,25(27)-二烯-1,3-二醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.