Aromadendrene Details

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Physical and Chemical properties

PUBCHEM ID	91354
Molecular Weight (g/mol)	204.351
Molecular Formula	C15H24
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
IUPAC Name	1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene
Canonical SMILES	C=C1CCC3C(C2C(C)CCC12)C3(C)C
PUBCHEM IUPAC INCHIKEY	ITYNGVSTWVVPIC-UHFFFAOYSA-N
Solubility Level	2
Vapour Pressure

Absorption and Metabolism information

XLOGP3 AA	4.7
CACTVS TPSA	0
BBB Level	0
Absorption Level	0
EXT PPB#Prediction	1
AlogP98	4.222
EXT CYP2D6#Prediction	0

Toxicological Information

Mouse Female FDA	Multi-Carcinogen
Mouse Male FDA	Multi-Carcinogen
Rat Female FDA	Single-Carcinogen
Rat Male FDA	Multi-Carcinogen
Ames Prediction	Non-Mutagen
Developmental / Reproductive Toxicity	Toxic
Rat Oral LD50	0.444549 g/kg_body_weight
Ocular Irritancy	Mild
Hepatotoxic#Prediction	0
Effected Human Genes

Ecological Information

Aerobic Biodegradability Prediction

Degradable

Hazard(s) Identification

Physical hazards	not classified
Health hazards	Moderate
Environmental hazards	not classified

About Table Headings

Compound Biological Activity

Plant Variety and Essential oils

Serial No.	Plant Name	Variety Name	Essential Oil	Compound Percentage
1	Curry tree		Murraya koenigii essential oil
2	Mexican pepperleaf		Piper auritum essential oil
3	Mexican pepperleaf		Piper auritum essential oil