Auranticin A
TL;DR: Auranticin A (CAS 133943-50-7) is a chemical compound with molecular formula C24H24O8 and molecular weight 440.14713 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-[1-[(E)-but-2-en-2-yl]-9-hydroxy-10-(hydroxymethyl)-3-methoxy-4-methyl-6-oxobenzo[b][1,4]benzodioxepin-7-yl]but-2-enoic acid
Also Known As: Auranticin A, (E)-3-[1-[(E)-but-2-en-2-yl]-9-hydroxy-10-(hydroxymethyl)-3-methoxy-4-methyl-6-oxobenzo[b][1,4]benzodioxepin-7-yl]but-2-enoic acid, 2-Butenoic acid, 3-(3-hydroxy-4-(hydroxymethyl)-8-methoxy-9-methyl-6-(1-methyl-1-propenyl)-11-oxo-11H-dibenzo(b,e)(1,4)dioxepin-1-yl)-, (E,E)-, (E)-3-(1-((E)-but-2-en-2-yl)-9-hydroxy-10-(hydroxymethyl)-3-methoxy-4-methyl-6-oxobenzo(b)(1,4)benzodioxepin-7-yl)but-2-enoic acid
Technical Specifications
| Molecular Formula | C24H24O8 |
| Molecular Weight | 440.14713 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 440.14713 Da |
| Heavy Atoms | 32 |
| Complexity | 774.0 |
| SMILES | C/C=C(\C)/C1=CC(=C(C2=C1OC3=C(C(=CC(=C3CO)O)/C(=C/C(=O)O)/C)C(=O)O2)C)OC |
| InChIKey | NTOXIMPFEPXTTB-GNXRPPCSSA-N |
Chemical Property Profile of Auranticin A
Property Insights of Auranticin A
The XLogP value of 4.8 indicates that Auranticin A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Auranticin A. Following Lipinski's Rule of Five, Auranticin A has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Auranticin A?
The CAS number of Auranticin A is 133943-50-7.
What is the molecular formula of Auranticin A?
The molecular formula of Auranticin A is C24H24O8.
What is the molecular weight of Auranticin A?
The molecular weight of Auranticin A is 440.14713 g/mol.
Where can I buy Auranticin A?
You can request a quote for Auranticin A directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Auranticin A?
Yes, CoreyChem provides custom synthesis services for Auranticin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.