矢车菊元素
TL;DR: 矢车菊元素 (CAS 17313-52-9) is a chemical compound with molecular formula C18H16O8 and molecular weight 360.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
矢车菊元素
5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6-dimethoxychromen-4-one
Also Known As: Centaureidin, Desmethoxycentaureidine, centaureidine, 5,7,3'-Trihydroxy-3,6,4'-trimethoxyflavone, quercetagetin 3,6,4'-trimethyl ether
| Molecular Formula | C18H16O8 |
|---|---|
| Molecular Weight | 360.08 g/mol |
| LogP | 2.6026 |
| Topological Polar Surface Area | 118.59 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 360.0845 |
| Heavy Atoms | 26 |
| Complexity | 1051.4661 |
Chemical Identifiers
| CAS Number | 17313-52-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(O2)C=C(C(=C3O)OC)O)OC)O |
Product Overview
矢车菊元素 (CAS 17313-52-9), with molecular formula C18H16O8 and molecular weight 360.08 g/mol. IUPAC: 5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6-dimethoxychromen-4-one.
Chemical Property Profile of 矢车菊元素
Property Insights of 矢车菊元素
The XLogP value of 2.6026 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 矢车菊元素. The TPSA of 118.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 矢车菊元素. Following Lipinski's Rule of Five, 矢车菊元素 has 3 hydrogen bond donor(s) and 8 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 矢车菊元素?
The CAS number of 矢车菊元素 is 17313-52-9.
What is the molecular formula of 矢车菊元素?
The molecular formula of 矢车菊元素 is C18H16O8.
What is the molecular weight of 矢车菊元素?
The molecular weight of 矢车菊元素 is 360.08 g/mol.
Where can I buy 矢车菊元素?
You can request a quote for 矢车菊元素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 矢车菊元素?
Yes, KEHONG BIO provides custom synthesis services for 矢车菊元素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.