Nimolinin
TL;DR: Nimolinin (CAS 126590-02-1) is a chemical compound with molecular formula C20H28O3 and molecular weight 316.20386 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4aR,10aR)-6,10a-dihydroxy-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,10-tetrahydrophenanthren-9-one
Also Known As: Nimolinin, 5,12-Dihydroxyabieta-8(14),9(11),12-trien-7-one, (4aR,10aR)-6,10a-dihydroxy-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,10-tetrahydrophenanthren-9-one, 9(1H)-Phenanthrenone, 2,3,4,4a,10,10a-hexahydro-6,10a-dihydroxy-1,1,4a-trimethyl-7-(1-methylethyl)-, (4aR-trans)-
Technical Specifications
| Molecular Formula | C20H28O3 |
| Molecular Weight | 316.20386 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 316.20386 Da |
| Heavy Atoms | 23 |
| Complexity | 497.0 |
| SMILES | CC(C)C1=C(C=C2C(=C1)C(=O)C[C@@]3([C@@]2(CCCC3(C)C)C)O)O |
| InChIKey | WOSMVRQDGSGWRR-WOJBJXKFSA-N |
Chemical Property Profile of Nimolinin
Property Insights of Nimolinin
The XLogP value of 4.2 indicates that Nimolinin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, Nimolinin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nimolinin has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Nimolinin?
The CAS number of Nimolinin is 126590-02-1.
What is the molecular formula of Nimolinin?
The molecular formula of Nimolinin is C20H28O3.
What is the molecular weight of Nimolinin?
The molecular weight of Nimolinin is 316.20386 g/mol.
Where can I buy Nimolinin?
You can request a quote for Nimolinin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Nimolinin?
Yes, CoreyChem provides custom synthesis services for Nimolinin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.