Podophyllotoxin glucoside
TL;DR: Podophyllotoxin glucoside (CAS 20110-25-2) is a chemical compound with molecular formula C28H32O13 and molecular weight 576.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5R,5aR,8aR,9R)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one
Also Known As: Podophyllotoxin glucoside, Podophyllotoxin 4-O-glucoside, prostaglandins B, podophyllotoxin-4-o-glucoside, SP-G Iia
| Molecular Formula | C28H32O13 |
|---|---|
| Molecular Weight | 576.18 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 172.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 7 |
| Exact Mass | 576.18427 |
| Heavy Atoms | 41 |
| Complexity | 907.0 |
Chemical Identifiers
| CAS Number | 20110-25-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@H](C4=CC5=C(C=C24)OCO5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O |
| InChIKey | NXVJTGLCCSFGAT-QNDDJFOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Podophyllotoxin glucoside (CAS 20110-25-2), with molecular formula C28H32O13 and molecular weight 576.18 g/mol. IUPAC: (5R,5aR,8aR,9R)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one.
Chemical Property Profile of Podophyllotoxin glucoside
Property Insights of Podophyllotoxin glucoside
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Podophyllotoxin glucoside. The TPSA of 172.0 Ų indicates high polarity, suggesting Podophyllotoxin glucoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Podophyllotoxin glucoside has 4 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Podophyllotoxin glucoside?
The CAS number of Podophyllotoxin glucoside is 20110-25-2.
What is the molecular formula of Podophyllotoxin glucoside?
The molecular formula of Podophyllotoxin glucoside is C28H32O13.
What is the molecular weight of Podophyllotoxin glucoside?
The molecular weight of Podophyllotoxin glucoside is 576.18 g/mol.
Where can I buy Podophyllotoxin glucoside?
You can request a quote for Podophyllotoxin glucoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Podophyllotoxin glucoside?
Yes, KEHONG BIO provides custom synthesis services for Podophyllotoxin glucoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.