(+)-8-Drimen-7-one
CNP0197378.1 · C15H24O · View on COCONUT ↗
Identifiers
| Name | (+)-8-Drimen-7-one |
|---|
| IUPAC Name | (4~{a}~{S},8~{a}~{S})-3,4,4~{a},8,8-pentamethyl-5,6,7,8~{a}-tetrahydro-1~{H}-naphthalen-2-one |
|---|
| COCONUT ID | CNP0197378.1 |
|---|
| InChIKey | VEEZSMVXABVRFI-DZGCQCFKSA-N |
|---|
| InChI | InChI=1S/C15H24O/c1-10-11(2)15(5)8-6-7-14(3,4)13(15)9-12(10)16/h13H,6-9H2,1-5H3/t13-,15+/m0/s1 |
|---|
| SMILES | CC1=C(C)[C@@]2(C)CCCC(C)(C)[C@@H]2CC1=O |
|---|
Properties
| Molecular Formula | C15H24O |
|---|
| Molecular Weight | 220.36 |
|---|
| Exact Mass | 220.18272 |
|---|
| Log P (ALogP) | 4.13 |
|---|
| TPSA | 17.07 |
|---|
| H-Bond Donors / Acceptors | 0 / 1 |
|---|
| Rotatable Bonds | 0 |
|---|
| Lipinski's Rule of 5 Violations | 0 |
|---|
| QED Drug-likeness | 0.60 |
|---|
| NP-likeness | 2.50 |
|---|
Classification
| NP Pathway | Terpenoids |
|---|
| NP Superclass | Sesquiterpenoids |
|---|
| NP Class | Drimane sesquiterpenoids |
|---|
| Chemical Superclass | Organic oxygen compounds |
|---|
| Chemical Class | Organooxygen compounds |
|---|
| Chemical Subclass | Carbonyl compounds |
|---|
Reported in GR-MAPs Plants
Data from COCONUT (COlleCtion of Open Natural prodUcTs), released under CC0. Chandrasekhar V. et al. COCONUT 2.0: a comprehensive overhaul and curation of the collection of open natural products database. Nucleic Acids Research (2024), doi:10.1093/nar/gkae1063. COCONUT release 2026-10.
