山扁豆酸
TL;DR: 山扁豆酸 (CAS 5443-15-2) is a chemical compound with molecular formula C16H10O7 and molecular weight 314.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
山扁豆酸
1,6,8-trihydroxy-3-methyl-9,10-dioxoanthracene-2-carboxylic acid
Also Known As: Endocrocin, ACon1_001814, 1,6,8-trihydroxy-3-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid, 1,6,8-trihydroxy-3-methyl-9,10-dioxoanthracene-2-carboxylic acid, 9,10-Dihydro-1,6,8-trihydroxy-3-methyl-9,10-dioxo-2-anthracenecarboxylic acid
| Molecular Formula | C16H10O7 |
|---|---|
| Molecular Weight | 314.04 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 314.04266 |
| Heavy Atoms | 23 |
| Complexity | 545.0 |
Chemical Identifiers
| CAS Number | 5443-15-2 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1C(=O)O)O)C(=O)C3=C(C2=O)C=C(C=C3O)O |
| InChIKey | UZOHDKGTYVTYDZ-UHFFFAOYSA-N |
Product Overview
山扁豆酸 (CAS 5443-15-2), with molecular formula C16H10O7 and molecular weight 314.04 g/mol. IUPAC: 1,6,8-trihydroxy-3-methyl-9,10-dioxoanthracene-2-carboxylic acid.
Chemical Property Profile of 山扁豆酸
Property Insights of 山扁豆酸
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 山扁豆酸. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 山扁豆酸. Following Lipinski's Rule of Five, 山扁豆酸 has 4 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 山扁豆酸?
The CAS number of 山扁豆酸 is 5443-15-2.
What is the molecular formula of 山扁豆酸?
The molecular formula of 山扁豆酸 is C16H10O7.
What is the molecular weight of 山扁豆酸?
The molecular weight of 山扁豆酸 is 314.04 g/mol.
Where can I buy 山扁豆酸?
You can request a quote for 山扁豆酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 山扁豆酸?
Yes, KEHONG BIO provides custom synthesis services for 山扁豆酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.