Melliferone
TL;DR: Melliferone (CAS 377724-68-0) is a chemical compound with molecular formula C30H44O3 and molecular weight 452.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,4S,5R,8R,13S,14R,17S,18R)-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-ene-10,23-dione
Also Known As: Melliferone, heptamethyl[?]dione, HY-N8701, J2.536.350G, 13-Hydroxy-3-oxooleana-11-ene-28-oic acid lactone
| Molecular Formula | C30H44O3 |
|---|---|
| Molecular Weight | 452.33 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 452.32904 |
| Heavy Atoms | 33 |
| Complexity | 975.0 |
Chemical Identifiers
| CAS Number | 377724-68-0 |
|---|---|
| SMILES | C[C@]12CCC(=O)C([C@@H]1CC[C@@]3([C@@H]2C=C[C@@]45[C@]3(CC[C@@]6([C@H]4CC(CC6)(C)C)C(=O)O5)C)C)(C)C |
| InChIKey | BHVMSBIGWPPGBF-LHAYROSJSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Melliferone (CAS 377724-68-0), with molecular formula C30H44O3 and molecular weight 452.33 g/mol. IUPAC: (1S,4S,5R,8R,13S,14R,17S,18R)-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-ene-10,23-dione.
Chemical Property Profile of Melliferone
Property Insights of Melliferone
The XLogP value of 6.8 indicates that Melliferone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, Melliferone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Melliferone has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Melliferone?
The CAS number of Melliferone is 377724-68-0.
What is the molecular formula of Melliferone?
The molecular formula of Melliferone is C30H44O3.
What is the molecular weight of Melliferone?
The molecular weight of Melliferone is 452.33 g/mol.
Where can I buy Melliferone?
You can request a quote for Melliferone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Melliferone?
Yes, KEHONG BIO provides custom synthesis services for Melliferone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.