11,13diene-20CH2OH-Glycyrrhizin
TL;DR: 11,13diene-20CH2OH-Glycyrrhizin (CAS 134250-14-9) is a chemical compound with molecular formula C42H68O12 and molecular weight 764.47107 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3R,4S,5S,6R)-2-[(2S,3R,4S,5S,6R)-2-[[(3S,4aR,6aR,6bS,8aS,11S,14bS)-11-(hydroxymethyl)-4,4,6a,6b,8a,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,14a-dodecahydropicen-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: 11,13diene-20CH2OH-Glycyrrhizin, 11,13-Diene-20CH2OH-glycyrrhizin, Oleanane,b-D-glucopyranoside deriv., Oleanane, b-D-glucopyranoside deriv., Olean-11,13(18)-diene-3beta,30-diol-3-O-beta-D-glucopyranosyl(1-2)beta-D-glucopyranoside
Technical Specifications
| Molecular Formula | C42H68O12 |
| Molecular Weight | 764.47107 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 199.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 7 |
| Exact Mass | 764.47107 Da |
| Heavy Atoms | 54 |
| Complexity | 1470.0 |
| SMILES | C[C@]12CC[C@](CC1=C3C=CC4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)C)(C)CO |
| InChIKey | VTBCKLZGHRRDFA-ARLZBQDQSA-N |
Chemical Property Profile of 11,13diene-20CH2OH-Glycyrrhizin
Property Insights of 11,13diene-20CH2OH-Glycyrrhizin
The XLogP value of 4.0 indicates that 11,13diene-20CH2OH-Glycyrrhizin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 199.0 Ų indicates high polarity, suggesting 11,13diene-20CH2OH-Glycyrrhizin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 11,13diene-20CH2OH-Glycyrrhizin has 8 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 11,13diene-20CH2OH-Glycyrrhizin?
The CAS number of 11,13diene-20CH2OH-Glycyrrhizin is 134250-14-9.
What is the molecular formula of 11,13diene-20CH2OH-Glycyrrhizin?
The molecular formula of 11,13diene-20CH2OH-Glycyrrhizin is C42H68O12.
What is the molecular weight of 11,13diene-20CH2OH-Glycyrrhizin?
The molecular weight of 11,13diene-20CH2OH-Glycyrrhizin is 764.47107 g/mol.
Where can I buy 11,13diene-20CH2OH-Glycyrrhizin?
You can request a quote for 11,13diene-20CH2OH-Glycyrrhizin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 11,13diene-20CH2OH-Glycyrrhizin?
Yes, CoreyChem provides custom synthesis services for 11,13diene-20CH2OH-Glycyrrhizin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.