Melianol
TL;DR: Melianol (CAS 16838-01-0) is a chemical compound with molecular formula C30H48O4 and molecular weight 472.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,5R)-5-(3,3-dimethyloxiran-2-yl)-3-[(3S,9R,10R,13S,14S,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]oxolan-2-ol
Also Known As: Melianol, Deacetylturreanthin, Melianol (tetracyclic triterpene), (2R,5R)-5-(3,3-dimethyloxiran-2-yl)-3-[(3S,9R,10R,13S,14S,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]oxolan-2-ol, 13a,14b,17bH-Lanost-7-ene-3b,21-diol, 21,23:24,25-diepoxy-
| Molecular Formula | C30H48O4 |
|---|---|
| Molecular Weight | 472.36 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 472.35526 |
| Heavy Atoms | 34 |
| Complexity | 892.0 |
Chemical Identifiers
| CAS Number | 16838-01-0 |
|---|---|
| SMILES | C[C@@]12CC[C@H]3C(=CCC4[C@@]3(CC[C@@H](C4(C)C)O)C)[C@]1(CC[C@@H]2C5C[C@@H](O[C@H]5O)C6C(O6)(C)C)C |
| InChIKey | DABHSVCBZNIZDT-WFJMIKGLSA-N |
Product Overview
Melianol (CAS 16838-01-0), with molecular formula C30H48O4 and molecular weight 472.36 g/mol. IUPAC: (2R,5R)-5-(3,3-dimethyloxiran-2-yl)-3-[(3S,9R,10R,13S,14S,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]oxolan-2-ol.
Chemical Property Profile of Melianol
Property Insights of Melianol
The XLogP value of 6.0 indicates that Melianol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Melianol. Following Lipinski's Rule of Five, Melianol has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Melianol?
The CAS number of Melianol is 16838-01-0.
What is the molecular formula of Melianol?
The molecular formula of Melianol is C30H48O4.
What is the molecular weight of Melianol?
The molecular weight of Melianol is 472.36 g/mol.
Where can I buy Melianol?
You can request a quote for Melianol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Melianol?
Yes, KEHONG BIO provides custom synthesis services for Melianol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.