Ambuic Acid
TL;DR: Ambuic Acid (CAS 340774-69-8) is a chemical compound with molecular formula C19H26O6 and molecular weight 350.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Ambuic Acid
(E)-4-[(1R,5S,6R)-3-[(E)-hept-1-enyl]-5-hydroxy-4-(hydroxymethyl)-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl]-2-methylbut-2-enoic acid
Also Known As: Ambuic acid, (+)-Ambuic Acid, (E)-4-[(1R,2S,6R)-4-[(E)-hept-1-enyl]-2-hydroxy-3-(hydroxymethyl)-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-6-yl]-2-methylbut-2-enoic acid
| Molecular Formula | C19H26O6 |
|---|---|
| Molecular Weight | 350.17 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 350.17294 |
| Heavy Atoms | 25 |
| Complexity | 630.0 |
Chemical Identifiers
| CAS Number | 340774-69-8 |
|---|---|
| SMILES | CCCCC/C=C/C1=C([C@@H]([C@@H]2[C@](C1=O)(O2)C/C=C(\C)/C(=O)O)O)CO |
| InChIKey | UDSQZJMGPSRCEM-MUCABQLJSA-N |
Product Overview
Ambuic Acid (CAS 340774-69-8), with molecular formula C19H26O6 and molecular weight 350.17 g/mol. IUPAC: (E)-4-[(1R,5S,6R)-3-[(E)-hept-1-enyl]-5-hydroxy-4-(hydroxymethyl)-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl]-2-methylbut-2-enoic acid.
Chemical Property Profile of Ambuic Acid
Property Insights of Ambuic Acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ambuic Acid. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ambuic Acid. Following Lipinski's Rule of Five, Ambuic Acid has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ambuic Acid?
The CAS number of Ambuic Acid is 340774-69-8.
What is the molecular formula of Ambuic Acid?
The molecular formula of Ambuic Acid is C19H26O6.
What is the molecular weight of Ambuic Acid?
The molecular weight of Ambuic Acid is 350.17 g/mol.
Where can I buy Ambuic Acid?
You can request a quote for Ambuic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ambuic Acid?
Yes, KEHONG BIO provides custom synthesis services for Ambuic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.