弗朗鼠李苷B
TL;DR: 弗朗鼠李苷B (CAS 14270-40-7) is a chemical compound with molecular formula C20H18O9 and molecular weight 402.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
弗朗鼠李苷B
3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-1,8-dihydroxy-6-methylanthracene-9,10-dione
Also Known As: Frangulin B, 4,5-dihydroxy-7-methyl-9,10-dioxo-9,10-dihydroanthracen-2-yl pentofuranoside, 3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-1,8-dihydroxy-6-methylanthracene-9,10-dione
| Molecular Formula | C20H18O9 |
|---|---|
| Molecular Weight | 402.10 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 154.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 402.0951 |
| Heavy Atoms | 29 |
| Complexity | 654.0 |
Chemical Identifiers
| CAS Number | 14270-40-7 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)OC4C(C(C(O4)CO)O)O |
| InChIKey | AMLHPEKHAAPTGM-UHFFFAOYSA-N |
Product Overview
弗朗鼠李苷B (CAS 14270-40-7), with molecular formula C20H18O9 and molecular weight 402.10 g/mol. IUPAC: 3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-1,8-dihydroxy-6-methylanthracene-9,10-dione.
Chemical Property Profile of 弗朗鼠李苷B
Property Insights of 弗朗鼠李苷B
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 弗朗鼠李苷B. The TPSA of 154.0 Ų indicates high polarity, suggesting 弗朗鼠李苷B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 弗朗鼠李苷B has 5 hydrogen bond donor(s) and 9 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 弗朗鼠李苷B?
The CAS number of 弗朗鼠李苷B is 14270-40-7.
What is the molecular formula of 弗朗鼠李苷B?
The molecular formula of 弗朗鼠李苷B is C20H18O9.
What is the molecular weight of 弗朗鼠李苷B?
The molecular weight of 弗朗鼠李苷B is 402.10 g/mol.
Where can I buy 弗朗鼠李苷B?
You can request a quote for 弗朗鼠李苷B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 弗朗鼠李苷B?
Yes, KEHONG BIO provides custom synthesis services for 弗朗鼠李苷B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.