Sakuranin
TL;DR: Sakuranin (CAS 529-39-5) is a chemical compound with molecular formula C22H24O10 and molecular weight 448.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(4-hydroxyphenyl)-7-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Also Known As: SAKURANIN, (-)-Sakuranin, SAKURANETIN, 5-.BETA.-D-GLUCOPYRANOSIDE, (2S)-2-(4-hydroxyphenyl)-7-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one, (s)-5-(
| Molecular Formula | C22H24O10 |
|---|---|
| Molecular Weight | 448.14 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 448.13693 |
| Heavy Atoms | 32 |
| Complexity | 638.0 |
Chemical Identifiers
| CAS Number | 529-39-5 |
|---|---|
| SMILES | COC1=CC2=C(C(=O)C[C@H](O2)C3=CC=C(C=C3)O)C(=C1)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O |
| InChIKey | NEPMMBQHELYZIW-YMTXFHFDSA-N |
Product Overview
Sakuranin (CAS 529-39-5), with molecular formula C22H24O10 and molecular weight 448.14 g/mol. IUPAC: (2S)-2-(4-hydroxyphenyl)-7-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one.
Chemical Property Profile of Sakuranin
Property Insights of Sakuranin
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sakuranin. The TPSA of 155.0 Ų indicates high polarity, suggesting Sakuranin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sakuranin has 5 hydrogen bond donor(s) and 10 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 Sakuranin?
The CAS number of Sakuranin is 529-39-5.
What is the molecular formula of Sakuranin?
The molecular formula of Sakuranin is C22H24O10.
What is the molecular weight of Sakuranin?
The molecular weight of Sakuranin is 448.14 g/mol.
Where can I buy Sakuranin?
You can request a quote for Sakuranin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sakuranin?
Yes, KEHONG BIO provides custom synthesis services for Sakuranin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.