Flavocommelin
TL;DR: Flavocommelin (CAS 16049-42-6) is a chemical compound with molecular formula C28H32O15 and molecular weight 608.17413 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-hydroxy-7-methoxy-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-[4-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
Also Known As: Flavocommelin, flavoconomelin, Flavocommelinin, Swertisin 4 -O-beta-D-glucopyranoside, 5-hydroxy-7-methoxy-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-[4-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
Technical Specifications
| Molecular Formula | C28H32O15 |
| Molecular Weight | 608.17413 g/mol |
| XLogP | -1.3 |
| Topological Polar Surface Area (TPSA) | 245.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 7 |
| Exact Mass | 608.17413 Da |
| Heavy Atoms | 43 |
| Complexity | 987.0 |
| SMILES | COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O |
| InChIKey | QLOUGKRWTZAXFE-JFECCKQBSA-N |
Chemical Property Profile of Flavocommelin
Property Insights of Flavocommelin
The XLogP value of -1.3 indicates that Flavocommelin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 245.0 Ų indicates high polarity, suggesting Flavocommelin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Flavocommelin has 9 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Flavocommelin?
The CAS number of Flavocommelin is 16049-42-6.
What is the molecular formula of Flavocommelin?
The molecular formula of Flavocommelin is C28H32O15.
What is the molecular weight of Flavocommelin?
The molecular weight of Flavocommelin is 608.17413 g/mol.
Where can I buy Flavocommelin?
You can request a quote for Flavocommelin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Flavocommelin?
Yes, CoreyChem provides custom synthesis services for Flavocommelin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.