Mer NF5003E
TL;DR: Mer NF5003E (CAS 159121-98-9) is a chemical compound with molecular formula C23H32O5 and molecular weight 388.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4'-dihydroxy-6'-(hydroxymethyl)-4,4,7,8a-tetramethylspiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3H-1-benzofuran]-7'-carbaldehyde
Also Known As: Mer NF5003E, Mer-NF5003E, ATCC 20928 factor C, Mer-NF-5003E, ATCC 20928 C
| Molecular Formula | C23H32O5 |
|---|---|
| Molecular Weight | 388.22 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 388.22498 |
| Heavy Atoms | 28 |
| Complexity | 620.0 |
Chemical Identifiers
| CAS Number | 159121-98-9 |
|---|---|
| SMILES | CC1CCC2C(C(CCC2(C13CC4=C(C=C(C(=C4O3)C=O)CO)O)C)O)(C)C |
| InChIKey | QKXGRPHIBLICSC-UHFFFAOYSA-N |
Product Overview
Mer NF5003E (CAS 159121-98-9), with molecular formula C23H32O5 and molecular weight 388.22 g/mol. IUPAC: 3,4'-dihydroxy-6'-(hydroxymethyl)-4,4,7,8a-tetramethylspiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3H-1-benzofuran]-7'-carbaldehyde.
Chemical Property Profile of Mer NF5003E
Property Insights of Mer NF5003E
The XLogP value of 3.5 indicates that Mer NF5003E is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mer NF5003E. Following Lipinski's Rule of Five, Mer NF5003E has 3 hydrogen bond donor(s) and 5 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 Mer NF5003E?
The CAS number of Mer NF5003E is 159121-98-9.
What is the molecular formula of Mer NF5003E?
The molecular formula of Mer NF5003E is C23H32O5.
What is the molecular weight of Mer NF5003E?
The molecular weight of Mer NF5003E is 388.22 g/mol.
Where can I buy Mer NF5003E?
You can request a quote for Mer NF5003E directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mer NF5003E?
Yes, KEHONG BIO provides custom synthesis services for Mer NF5003E and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.