Isorubijervosine
TL;DR: Isorubijervosine (CAS 468-46-2) is a chemical compound with molecular formula C33H53NO7 and molecular weight 575.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(hydroxymethyl)-6-[[(7S,10R,14R,15R,16S,17R,20S,23S)-14-(hydroxymethyl)-10,16,20-trimethyl-22-azahexacyclo[12.10.0.02,11.05,10.015,23.017,22]tetracos-4-en-7-yl]oxy]oxane-3,4,5-triol
Also Known As: ISORUBIJERVOSINE, (8xi,9xi,14xi)-18-Hydroxysolanid-5-en-3beta-yl hexopyranoside
| Molecular Formula | C33H53NO7 |
|---|---|
| Molecular Weight | 575.38 g/mol |
| LogP | 2.4516 |
| Topological Polar Surface Area | 122.85 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 575.3822 |
| Heavy Atoms | 41 |
| Complexity | 1021.5405 |
Chemical Identifiers
| CAS Number | 468-46-2 |
|---|---|
| SMILES | C[C@H]1CC[C@@H]2[C@H]([C@H]3[C@@H](N2C1)CC4[C@@]3(CCC5C4CC=C6[C@@]5(CC[C@@H](C6)OC7C(C(C(C(O7)CO)O)O)O)C)CO)C |
Product Overview
Isorubijervosine (CAS 468-46-2), with molecular formula C33H53NO7 and molecular weight 575.38 g/mol. IUPAC: 2-(hydroxymethyl)-6-[[(7S,10R,14R,15R,16S,17R,20S,23S)-14-(hydroxymethyl)-10,16,20-trimethyl-22-azahexacyclo[12.10.0.02,11.05,10.015,23.017,22]tetracos-4-en-7-yl]oxy]oxane-3,4,5-triol.
Chemical Property Profile of Isorubijervosine
Property Insights of Isorubijervosine
The XLogP value of 2.4516 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isorubijervosine. The TPSA of 122.85 Ų falls within the moderate polarity range, balancing permeability and solubility for Isorubijervosine. Following Lipinski's Rule of Five, Isorubijervosine has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isorubijervosine?
The CAS number of Isorubijervosine is 468-46-2.
What is the molecular formula of Isorubijervosine?
The molecular formula of Isorubijervosine is C33H53NO7.
What is the molecular weight of Isorubijervosine?
The molecular weight of Isorubijervosine is 575.38 g/mol.
Where can I buy Isorubijervosine?
You can request a quote for Isorubijervosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isorubijervosine?
Yes, KEHONG BIO provides custom synthesis services for Isorubijervosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.