Betulafolienetriol
TL;DR: Betulafolienetriol (CAS 6892-79-1) is a chemical compound with molecular formula C30H52O3 and molecular weight 460.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,8R,9R,10R,12R,13R,14S,17S)-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol
Also Known As: Folienetriol, Betulafolienetriol, Betulafolientriol, Protopanaxadiol, 3-Epibetulafolientriol
| Molecular Formula | C30H52O3 |
|---|---|
| Molecular Weight | 460.39 g/mol |
| LogP | 6.5006 |
| Topological Polar Surface Area | 60.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 460.39163 |
| Heavy Atoms | 33 |
| Complexity | 779.4112 |
Chemical Identifiers
| CAS Number | 6892-79-1 |
|---|---|
| SMILES | CC(=CCC[C@@](C)([C@H]1CC[C@]2([C@@H]1[C@@H](C[C@H]3[C@]2(CCC4[C@@]3(CC[C@H](C4(C)C)O)C)C)O)C)O)C |
Product Overview
Betulafolienetriol (CAS 6892-79-1), with molecular formula C30H52O3 and molecular weight 460.39 g/mol. IUPAC: (3R,8R,9R,10R,12R,13R,14S,17S)-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol.
Chemical Property Profile of Betulafolienetriol
Property Insights of Betulafolienetriol
The XLogP value of 6.5006 indicates that Betulafolienetriol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.69 Ų falls within the moderate polarity range, balancing permeability and solubility for Betulafolienetriol. Following Lipinski's Rule of Five, Betulafolienetriol has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Betulafolienetriol?
The CAS number of Betulafolienetriol is 6892-79-1.
What is the molecular formula of Betulafolienetriol?
The molecular formula of Betulafolienetriol is C30H52O3.
What is the molecular weight of Betulafolienetriol?
The molecular weight of Betulafolienetriol is 460.39 g/mol.
Where can I buy Betulafolienetriol?
You can request a quote for Betulafolienetriol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Betulafolienetriol?
Yes, KEHONG BIO provides custom synthesis services for Betulafolienetriol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.