Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate
TL;DR: Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate (CAS 57289-54-0) is a chemical compound with molecular formula C21H34O4 and molecular weight 350.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(7-hydroxy-1,4b,8,8-tetramethyl-10-oxo-2,3,4,4a,5,6,7,8a,9,10a-decahydro-1H-phenanthren-2-yl)acetate
Also Known As: Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate, Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate #, 2-Phenanthreneacetic acid, tetradecahydro-7-hydroxy-1,4b,8,8-tetramethyl-10-oxo-, methyl ester, methyl 2-(7-hydroxy-1,4b,8,8-tetramethyl-10-oxo-tetradecahydrophenanthren-2-yl)acetate, Tetradecahydro-7-hydroxy-1,4b,8,8-tetramethyl-10-oxo-2-phenanthreneacetic acid methyl ester
| Molecular Formula | C21H34O4 |
|---|---|
| Molecular Weight | 350.25 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.2457 |
| Heavy Atoms | 25 |
| Complexity | 554.0 |
Chemical Identifiers
| CAS Number | 57289-54-0 |
|---|---|
| SMILES | CC1C(CCC2C1C(=O)CC3C2(CCC(C3(C)C)O)C)CC(=O)OC |
| InChIKey | CCFHETNKPZXRKX-UHFFFAOYSA-N |
Product Overview
Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate (CAS 57289-54-0), with molecular formula C21H34O4 and molecular weight 350.25 g/mol. IUPAC: methyl 2-(7-hydroxy-1,4b,8,8-tetramethyl-10-oxo-2,3,4,4a,5,6,7,8a,9,10a-decahydro-1H-phenanthren-2-yl)acetate.
Chemical Property Profile of Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate
Property Insights of Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate
The XLogP value of 3.7 indicates that Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate. Following Lipinski's Rule of Five, Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate has 1 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 Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate?
The CAS number of Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate is 57289-54-0.
What is the molecular formula of Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate?
The molecular formula of Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate is C21H34O4.
What is the molecular weight of Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate?
The molecular weight of Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate is 350.25 g/mol.
Where can I buy Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate?
You can request a quote for Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl (3-hydroxy-14-methyl-7-oxopodocarpan-13-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.