(E)-Nerolidol Details

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Physical and Chemical properties

PUBCHEM ID	5320128
CAS Registry Number	0.0
Aroma Threshold	0.0
Molecular Weight (g/mol)	222.366
Molecular Formula	C15H26O
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	7
IUPAC Name	(6Z)-3,7,11-trimethyldodeca-1,6,10-trien-3-ol
Canonical SMILES	C=CC(C)(O)CC/C=C(C)/CC/C=C(C)/C
PUBCHEM IUPAC INCHIKEY	FQTLCLSUCSAZDY-KAMYIIQDSA-N
Solubility Level	3
Vapour Pressure	-2.905

Absorption and Metabolism information

XLOGP3 AA	4.6
CACTVS TPSA	20.2
BBB Level	0
Absorption Level	0
EXT PPB#Prediction	1
AlogP98	4.561
EXT CYP2D6#Prediction	0

Toxicological Information

Mouse Female FDA	Non-Carcinogen
Mouse Male FDA	Multi-Carcinogen
Rat Female FDA	Single-Carcinogen
Rat Male FDA	Non-Carcinogen
Ames Prediction	Non-Mutagen
Developmental / Reproductive Toxicity	Toxic
Rat Oral LD50	3.19125 g/kg_body_weight
Ocular Irritancy	None
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

Serial No.	Activity Name	Details	References (PubMed)	Other details EPA (U.S)	Clinical Trials (U.S. NIH)
1				3790-78-1	(E)-Nerolidol

Plant Variety and Essential oils

Serial No.	Plant Name	Variety Name	Essential Oil	Compound Percentage
1	Chamomile, German chamomile, Gule-babuna	CIM-Sammohak	Chamomila recutita essential oil
2	Chamomile, German chamomile, Gule-babuna	CIM-Sammohak	Chamomila recutita essential oil
3	Chamomile, German chamomile, Gule-babuna	Prasant	Chamomilla recutita Prasant essential oil
4	French basil, Indian basil, Sweet basil	CIM-Sharada	Ocimum basilicum CIM-Sharada essential oil
5	Menthol mint, Corn mint, Japanese mint	Gomti	Mentha arvensis Gomti essential oil
6	Menthol mint, Corn mint, Japanese mint	Damroo	Mentha arvensis Damroo essential oil
7	Menthol mint, Corn mint, Japanese mint	Himalaya	Mentha arvensis Himalaya essential oil
8	Menthol mint, Corn mint, Japanese mint	Kalka	Mentha arvensis Kalka essential oil
9	Menthol mint, Corn mint, Japanese mint	Kosi	Mentha arvensis Kosi essential oil
10	Menthol mint, Corn mint, Japanese mint	Kushal	Mentha arvensis Kushal essential oil
11	Menthol mint, Corn mint, Japanese mint	MAS-1	Mentha arvensis MAS-1 essential oil
12	Menthol mint, Corn mint, Japanese mint	Saksham	Mentha arvensis Saksham essential oil
13	Menthol mint, Corn mint, Japanese mint	Sambhav	Mentha arvensis Sambhav essential oil
14	Lavandula angustifolia	Sher-e-Kashmir	Lavandula angustifolia sher-e-Kashmir
15	Hook		Cymbopogon microstachys
16	Citronella		Cymbopogon nardus
17	Curry tree		Murraya koenigii essential oil
18	Chandan		Santalum album
19	Menthol mint, Corn mint, Japanese mint	CIM-Kranti	Mentha arvensis CIM-Kranti essential oil
20	Menthol mint, Corn mint, Japanese mint	CIM-Saryu	Mentha arvensis CIM-Saryu essential oil
21	Kuth		Saussurea lappa
22	Lemon balm		Melissa officinalis essential oil
23	Frangipani		Plumeria obtusa essential oil
24	Frangipani		Plumeria obtusa essential oil
25	Shampoo ginger. Bitter ginger		Zingiber zerumbet essential oil
26	Ginger		Zingiber officinale essential oil
27	Goatweed		Ageratum conyzoides essential oil
28	Yellow bugle		Ajuga chamaepitys essential oil
29	Golden trumpet		Allamanda cathartica essential oil
30	Lemon verbena		Aloysia citrodora essential oil
31	Sitafal		Annona cherimola essential oil
32	Sitafal		Annona cherimola essential oil
33	Sitafal		Annona cherimola essential oil
34	Custard apple		Annona reticulata essential oil
35	Hibiscus surattensis		Hibiscus surattensis essential oil