Orientin 7,3'-dimethyl ether
TL;DR: Orientin 7,3'-dimethyl ether (CAS 89915-55-9) is a chemical compound with molecular formula C23H24O11 and molecular weight 476.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
Also Known As: Orientin 7,3'-dimethyl ether, 4H-1-Benzopyran-4-one, 8-beta-D-glucopyranosyl-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-, (1S)-1,5-Anhydro-1-[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4-oxo-4H-1-benzopyran-8-yl]-D-glucitol, 1,5-Anhydro-1-[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4-oxo-4H-1-benzopyran-8-yl]hexitol, 5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
| Molecular Formula | C23H24O11 |
|---|---|
| Molecular Weight | 476.13 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 476.13187 |
| Heavy Atoms | 34 |
| Complexity | 759.0 |
Chemical Identifiers
| CAS Number | 89915-55-9 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3O)OC)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O |
| InChIKey | SFCOOUKNSXBTFD-CKSGFJDPSA-N |
Product Overview
Orientin 7,3'-dimethyl ether (CAS 89915-55-9), with molecular formula C23H24O11 and molecular weight 476.13 g/mol. IUPAC: 5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one.
Chemical Property Profile of Orientin 7,3'-dimethyl ether
Property Insights of Orientin 7,3'-dimethyl ether
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Orientin 7,3'-dimethyl ether. The TPSA of 175.0 Ų indicates high polarity, suggesting Orientin 7,3'-dimethyl ether may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Orientin 7,3'-dimethyl ether has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Orientin 7,3'-dimethyl ether?
The CAS number of Orientin 7,3'-dimethyl ether is 89915-55-9.
What is the molecular formula of Orientin 7,3'-dimethyl ether?
The molecular formula of Orientin 7,3'-dimethyl ether is C23H24O11.
What is the molecular weight of Orientin 7,3'-dimethyl ether?
The molecular weight of Orientin 7,3'-dimethyl ether is 476.13 g/mol.
Where can I buy Orientin 7,3'-dimethyl ether?
You can request a quote for Orientin 7,3'-dimethyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Orientin 7,3'-dimethyl ether?
Yes, KEHONG BIO provides custom synthesis services for Orientin 7,3'-dimethyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.