Glucopiericidinol A1
TL;DR: Glucopiericidinol A1 (CAS 125591-38-0) is a chemical compound with molecular formula C31H47NO10 and molecular weight 593.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1E,5E,7E,11E)-3-hydroxy-3,7,9,11-tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytrideca-1,5,7,11-tetraenyl]-5,6-dimethoxy-3-methyl-1H-pyridin-4-one
Also Known As: Glucopiericidinol A1, Glucopiericidinol A2, 2-[(1E,5E,7E,11E)-3-hydroxy-3,7,9,11-tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytrideca-1,5,7,11-tetraenyl]-5,6-dimethoxy-3-methyl-1H-pyridin-4-one, 2-((1E,5E,7E,11E)-3-hydroxy-3,7,9,11-tetramethyl-10-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxytrideca-1,5,7,11-tetraenyl)-5,6-dimethoxy-3-methyl-1H-pyridin-4-one, b-D-Glucopyranoside, 8-hydroxy-10-(4-hydroxy-5,6-dimethoxy-3-methyl-2-pyridinyl)-2,4,8-trimethyl-1-(1-methyl-1-propenyl)-3,5,9-decatrienyl-
| Molecular Formula | C31H47NO10 |
|---|---|
| Molecular Weight | 593.32 g/mol |
| LogP | 2.14472 |
| Topological Polar Surface Area | 170.93 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 13 |
| Exact Mass | 593.32 |
| Heavy Atoms | 42 |
| Complexity | 1212.8035 |
Chemical Identifiers
| CAS Number | 125591-38-0 |
|---|---|
| SMILES | C/C=C(\C)/C(C(C)/C=C(\C)/C=C/CC(C)(/C=C/C1=C(C(=O)C(=C(N1)OC)OC)C)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O |
Product Overview
Glucopiericidinol A1 (CAS 125591-38-0), with molecular formula C31H47NO10 and molecular weight 593.32 g/mol. IUPAC: 2-[(1E,5E,7E,11E)-3-hydroxy-3,7,9,11-tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytrideca-1,5,7,11-tetraenyl]-5,6-dimethoxy-3-methyl-1H-pyridin-4-one.
Chemical Property Profile of Glucopiericidinol A1
Property Insights of Glucopiericidinol A1
The XLogP value of 2.14472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Glucopiericidinol A1. The TPSA of 170.93 Ų indicates high polarity, suggesting Glucopiericidinol A1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Glucopiericidinol A1 has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Glucopiericidinol A1?
The CAS number of Glucopiericidinol A1 is 125591-38-0.
What is the molecular formula of Glucopiericidinol A1?
The molecular formula of Glucopiericidinol A1 is C31H47NO10.
What is the molecular weight of Glucopiericidinol A1?
The molecular weight of Glucopiericidinol A1 is 593.32 g/mol.
Where can I buy Glucopiericidinol A1?
You can request a quote for Glucopiericidinol A1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glucopiericidinol A1?
Yes, KEHONG BIO provides custom synthesis services for Glucopiericidinol A1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.