Asphodelin
TL;DR: Asphodelin (CAS 51419-55-7) is a chemical compound with molecular formula C30H18O8 and molecular weight 506.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,8-dihydroxy-6-methyl-9,10-dioxoanthracen-2-yl)-4,5-dihydroxy-2-methylanthracene-9,10-dione
Also Known As: Asphodelin, 1-(1,8-dihydroxy-6-methyl-9,10-dioxoanthracen-2-yl)-4,5-dihydroxy-2-methylanthracene-9,10-dione, (1,2'-Bianthracene)-9,9',10,10'-tetrone, 1',4,5,8'-tetrahydroxy-2,6'-dimethyl-, 1',4,5,8'-tetrahydroxy-2,6'-dimethyl-1,2'-bianthracene-9,9',10,10'-tetrone, 1',4,5,8'-Tetrahydroxy-2,6'-dimethyl[1,2'-bianthracene]-9,9',10,10'-tetrone
| Molecular Formula | C30H18O8 |
|---|---|
| Molecular Weight | 506.10 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 506.10016 |
| Heavy Atoms | 38 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 51419-55-7 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC(=C3O)C4=C5C(=C(C=C4C)O)C(=O)C6=C(C5=O)C=CC=C6O |
| InChIKey | BXWGUDGILDGCGB-UHFFFAOYSA-N |
Product Overview
Asphodelin (CAS 51419-55-7), with molecular formula C30H18O8 and molecular weight 506.10 g/mol. IUPAC: 1-(1,8-dihydroxy-6-methyl-9,10-dioxoanthracen-2-yl)-4,5-dihydroxy-2-methylanthracene-9,10-dione.
Chemical Property Profile of Asphodelin
Property Insights of Asphodelin
The XLogP value of 5.9 indicates that Asphodelin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 149.0 Ų indicates high polarity, suggesting Asphodelin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Asphodelin has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Asphodelin?
The CAS number of Asphodelin is 51419-55-7.
What is the molecular formula of Asphodelin?
The molecular formula of Asphodelin is C30H18O8.
What is the molecular weight of Asphodelin?
The molecular weight of Asphodelin is 506.10 g/mol.
Where can I buy Asphodelin?
You can request a quote for Asphodelin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Asphodelin?
Yes, KEHONG BIO provides custom synthesis services for Asphodelin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.