Neophytadiene Details
:
IUPAC Name
7,11,15-trimethyl-3-methylidenehexadec-1-ene
:Chemical Class
Diterpene
:CAS Registry Number
:Description
Neophytadiene is a diterpene characterized by a 3-methylidenehexadec-1-ene backbone with methyl groups at positions 7, 11, and 15. It functions as an antimicrobial and anti-inflammatory agent and acts as a metabolite in plants and algae. As both an alkene and a diterpene, neophytadiene plays various biological roles.
:Fragrance Type
Physical and Chemical properties
Absorption and Metabolism information
| XLOGP3 AA | 4.8 |
| CACTVS TPSA | 0 |
| BBB Level | 4 |
| Absorption Level | 3 |
| EXT PPB#Prediction | 1 |
| AlogP98 | 8.091 |
| EXT CYP2D6#Prediction | 0 |
Toxicological Information
| Mouse Female FDA | Multi-Carcinogen |
| Mouse Male FDA | Multi-Carcinogen |
| Rat Female FDA | Single-Carcinogen |
| Rat Male FDA | Non-Carcinogen |
| Ames Prediction | Non-Mutagen |
| Developmental / Reproductive Toxicity | |
| Rat Oral LD50 | 6.28567 g/kg_body_weight |
| Ocular Irritancy | None |
| Hepatotoxic#Prediction | 0 |
| Effected Human Genes |
Ecological Information
| Aerobic Biodegradability Prediction | Non-Degradable |
Hazard(s) Identification
| Physical hazards | not classified |
| Health hazards | |
| Environmental hazards | not classified |
Compound Biological Activity
| Serial No. | Activity Name | Details | References (PubMed) | Other details EPA (U.S) | Clinical Trials (U.S. NIH) |
|---|---|---|---|---|---|
| 1 | Anti-inflammatory | 15 | 31981060 | Neophytadiene | |
| 2 | Anti-inflammatory | 15 | 31981060 | Neophytadiene |
Plant Variety and Essential oils
| Serial No. | Plant Name | Variety Name | Essential Oil | Compound Percentage |
|---|---|---|---|---|
| 1 | fools watercress | Apium nodiflorum Essentail oil |
