5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione
TL;DR: 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione (CAS 35717-50-1) is a chemical compound with molecular formula C23H30O3 and molecular weight 354.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-4a,6a-dimethyl-4,4b,5,6,9,10,10a,11,11a,11b,12,13-dodecahydro-3H-indeno[2,1-a]phenanthrene-2,8-dione
Also Known As: 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione, 5-hydroxy-4a,6a-dimethyl-4,4b,5,6,9,10,10a,11,11a,11b,12,13-, 5-hydroxy-4a,6a-dimethyl-4,4b,5,6,9,10,10a,11,11a,11b,12,13-dodecahydro-3H-indeno[2,1-a]phenanthrene-2,8-dione
| Molecular Formula | C23H30O3 |
|---|---|
| Molecular Weight | 354.22 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 354.21948 |
| Heavy Atoms | 26 |
| Complexity | 747.0 |
Chemical Identifiers
| CAS Number | 35717-50-1 |
|---|---|
| SMILES | CC12CCC(=O)C=C1CCC3C2C(CC4(C3CC5C4=CC(=O)CC5)C)O |
| InChIKey | XWMBHIGLRZXCTJ-UHFFFAOYSA-N |
Product Overview
5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione (CAS 35717-50-1), with molecular formula C23H30O3 and molecular weight 354.22 g/mol. IUPAC: 5-hydroxy-4a,6a-dimethyl-4,4b,5,6,9,10,10a,11,11a,11b,12,13-dodecahydro-3H-indeno[2,1-a]phenanthrene-2,8-dione.
Chemical Property Profile of 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione
Property Insights of 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione. With a topological polar surface area (TPSA) of 54.4 Ų, 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione has 1 hydrogen bond donor(s) and 3 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 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione?
The CAS number of 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione is 35717-50-1.
What is the molecular formula of 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione?
The molecular formula of 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione is C23H30O3.
What is the molecular weight of 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione?
The molecular weight of 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione is 354.22 g/mol.
Where can I buy 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione?
You can request a quote for 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-hydroxy-4a,6a-dimethyl-4,4a,4b,5,6,6a,9,10,10a,11,11a,11b,12,13-tetradecahydro-2h-indeno[2,1-a]phenanthrene-2,8(3h)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.