Alliospiroside A
TL;DR: Alliospiroside A (CAS 125225-63-0) is a chemical compound with molecular formula C38H60O12 and molecular weight 708.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4,5-dihydroxy-2-(16-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-14-yl)oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
Also Known As: Alliospiroside A, Spirostane -2H, + 1O, O-Pen-dHex, 25(S)-Ruscogenin 1-O-alpha-L-rhamnopyranosyl-(1-->2)-beta-D-xylopyranoside, B0005-053934, 25(S)-Ruscogenin 1-O-alpha-L-rhamnopy-ranosyl-(1-->2)-beta-D-xylopyranoside
| Molecular Formula | C38H60O12 |
|---|---|
| Molecular Weight | 708.41 g/mol |
| LogP | 1.9998 |
| Topological Polar Surface Area | 176.76 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 708.40845 |
| Heavy Atoms | 50 |
| Complexity | 1288.0648 |
Chemical Identifiers
| CAS Number | 125225-63-0 |
|---|---|
| SMILES | CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(C(CC(C6)O)OC7C(C(C(CO7)O)O)OC8C(C(C(C(O8)C)O)O)O)C)C)C)OC1 |
Product Overview
Alliospiroside A (CAS 125225-63-0), with molecular formula C38H60O12 and molecular weight 708.41 g/mol. IUPAC: 2-[4,5-dihydroxy-2-(16-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-14-yl)oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol.
Chemical Property Profile of Alliospiroside A
Property Insights of Alliospiroside A
The XLogP value of 1.9998 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alliospiroside A. The TPSA of 176.76 Ų indicates high polarity, suggesting Alliospiroside A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Alliospiroside A has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Alliospiroside A?
The CAS number of Alliospiroside A is 125225-63-0.
What is the molecular formula of Alliospiroside A?
The molecular formula of Alliospiroside A is C38H60O12.
What is the molecular weight of Alliospiroside A?
The molecular weight of Alliospiroside A is 708.41 g/mol.
Where can I buy Alliospiroside A?
You can request a quote for Alliospiroside A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alliospiroside A?
Yes, KEHONG BIO provides custom synthesis services for Alliospiroside A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.