Hexahydrocurcumin
TL;DR: Hexahydrocurcumin (CAS 100667-86-5) is a chemical compound with molecular formula C21H26O6 and molecular weight 374.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptan-3-one
Also Known As: Hexahydrocurcumin, Curcumin, hexahydro-, Curcumin Impurity 1, 5-epihexahydrocurcumin, Hexahydrocurcumin Impurity
| Molecular Formula | C21H26O6 |
|---|---|
| Molecular Weight | 374.17 g/mol |
| LogP | 3.0005 |
| Topological Polar Surface Area | 96.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 374.17294 |
| Heavy Atoms | 27 |
| Complexity | 771.2623 |
Chemical Identifiers
| CAS Number | 100667-86-5 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)CCC(CC(=O)CCC2=CC(=C(C=C2)O)OC)O)O |
Product Overview
Hexahydrocurcumin (CAS 100667-86-5), with molecular formula C21H26O6 and molecular weight 374.17 g/mol. IUPAC: 5-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptan-3-one.
Chemical Property Profile of Hexahydrocurcumin
Property Insights of Hexahydrocurcumin
The XLogP value of 3.0005 indicates that Hexahydrocurcumin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexahydrocurcumin. Following Lipinski's Rule of Five, Hexahydrocurcumin 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 Hexahydrocurcumin?
The CAS number of Hexahydrocurcumin is 100667-86-5.
What is the molecular formula of Hexahydrocurcumin?
The molecular formula of Hexahydrocurcumin is C21H26O6.
What is the molecular weight of Hexahydrocurcumin?
The molecular weight of Hexahydrocurcumin is 374.17 g/mol.
Where can I buy Hexahydrocurcumin?
You can request a quote for Hexahydrocurcumin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexahydrocurcumin?
Yes, KEHONG BIO provides custom synthesis services for Hexahydrocurcumin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.