N-Acetyl tetrahydrojervone
TL;DR: N-Acetyl tetrahydrojervone (CAS 7505-25-1) is a chemical compound with molecular formula C29H43NO4 and molecular weight 469.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4'-acetyl-3',6',10,11b-tetramethylspiro[2,4,4a,5,6,6a,6b,7,8,10,10a,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-3,11-dione
Also Known As: N-Acetyl tetrahydrojervone, JERVONE, N-ACETYLTETRAHYDRO-, 28-Acetyl-5,6,12,13-tetrahydro-17,23-epoxyveratraman-3,11-dione, 4'-acetyl-3',6',10,11b-tetramethylspiro[2,4,4a,5,6,6a,6b,7,8,10,10a,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-3,11-dione
| Molecular Formula | C29H43NO4 |
|---|---|
| Molecular Weight | 469.32 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 63.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 469.3192 |
| Heavy Atoms | 34 |
| Complexity | 916.0 |
Chemical Identifiers
| CAS Number | 7505-25-1 |
|---|---|
| SMILES | CC1CC2C(C(C3(O2)CCC4C5CCC6CC(=O)CCC6(C5C(=O)C4C3C)C)C)N(C1)C(=O)C |
| InChIKey | DPNZKCBORUTORG-UHFFFAOYSA-N |
Product Overview
N-Acetyl tetrahydrojervone (CAS 7505-25-1), with molecular formula C29H43NO4 and molecular weight 469.32 g/mol. IUPAC: 4'-acetyl-3',6',10,11b-tetramethylspiro[2,4,4a,5,6,6a,6b,7,8,10,10a,11a-dodecahydro-1H-benzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-3,11-dione.
Chemical Property Profile of N-Acetyl tetrahydrojervone
Property Insights of N-Acetyl tetrahydrojervone
The XLogP value of 4.0 indicates that N-Acetyl tetrahydrojervone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Acetyl tetrahydrojervone. Following Lipinski's Rule of Five, N-Acetyl tetrahydrojervone has 0 hydrogen bond donor(s) and 4 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 N-Acetyl tetrahydrojervone?
The CAS number of N-Acetyl tetrahydrojervone is 7505-25-1.
What is the molecular formula of N-Acetyl tetrahydrojervone?
The molecular formula of N-Acetyl tetrahydrojervone is C29H43NO4.
What is the molecular weight of N-Acetyl tetrahydrojervone?
The molecular weight of N-Acetyl tetrahydrojervone is 469.32 g/mol.
Where can I buy N-Acetyl tetrahydrojervone?
You can request a quote for N-Acetyl tetrahydrojervone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Acetyl tetrahydrojervone?
Yes, KEHONG BIO provides custom synthesis services for N-Acetyl tetrahydrojervone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.