![(1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one structure](/static/products/8200/82003-84-7.webp)
(1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one
TL;DR: (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one (CAS 82003-84-7) is a chemical compound with molecular formula C15H22O3 and molecular weight 250.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one
Also Known As: Naphtho(1,8-bc)pyran-2(3H)-one, decahydro-9-hydroxy-6,9-dimethyl-3-methylene-, (3aR,6R,6aS,9R,9aR,9bS)-, 9-Hydroxy-6,9-dimethyl-3-methylidenedecahydronaphtho[1,8-bc]pyran-2(3H)-one, (3aR,6R,6aS,9R,9aR)-9-Hydroxy-6,9-dimethyl-3-methylidenedecahydronaphtho[1,8-bc]pyran-2(3H)-one
| Molecular Formula | C15H22O3 |
|---|---|
| Molecular Weight | 250.16 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 250.15689 |
| Heavy Atoms | 18 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 82003-84-7 |
|---|---|
| SMILES | C[C@@H]1CC[C@@H]2C3[C@H]1CC[C@@]([C@@H]3OC(=O)C2=C)(C)O |
| InChIKey | YDQMBNMUQASHKN-UMXFSUFJSA-N |
Product Overview
(1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one (CAS 82003-84-7), with molecular formula C15H22O3 and molecular weight 250.16 g/mol. IUPAC: (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one.
Chemical Property Profile of (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one
Property Insights of (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one. With a topological polar surface area (TPSA) of 46.5 Ų, (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one 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 (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one?
The CAS number of (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one is 82003-84-7.
What is the molecular formula of (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one?
The molecular formula of (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one is C15H22O3.
What is the molecular weight of (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one?
The molecular weight of (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one is 250.16 g/mol.
Where can I buy (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one?
You can request a quote for (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one?
Yes, KEHONG BIO provides custom synthesis services for (1R,5R,8R,9S,12R)-12-hydroxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridecan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.