13-epimanool, 1438-62-6

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CODE160340 CODE160340
Product(s):
1438-62-6 13-Epimanool >98%
13-Epimanool is a diterpenoid compound found in the herbs of Salvia prionitis.

Name:	5-[(1R,8aS)-4,4,8a-trimethyl-7-methylidene-2,3,4a,5,6,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol
CAS Number:	1438-62-6	3D/inchi
FDA UNII:	Search
MDL:	MFCD01310996
XlogP3-AA:	5.60 (est)
Molecular Weight:	290.49018000
Formula:	C20 H34 O
NMR Predictor:	Predict (works with chrome, Edge or firefox)

Category:natural substances and extractives

US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:

Google Scholar:	Search
Google Books:	Search
Google Scholar: with word "volatile"	Search
Google Scholar: with word "flavor"	Search
Google Scholar: with word "odor"	Search
Google Patents:	Search
US Patents:	Search
EU Patents:	Search
Pubchem Patents:	Search
PubMed:	Search
NCBI:	Search

Physical Properties:

Assay:	95.00 to 100.00
Food Chemicals Codex Listed:	No
Soluble in:
	water, 0.03955 mg/L @ 25 °C (est)

Organoleptic Properties:

Odor and/or flavor descriptions from others (if found).

Cosmetic Information:

None found

Suppliers:

BOC Sciences

For experimental / research use only.

13-Epimanool >98%

Odor: characteristic

Use: 13-Epimanool is a diterpenoid compound found in the herbs of Salvia prionitis.

Safety Information:


Hazards identification

Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements

Pictogram

Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined

Safety in Use Information:

Category:
natural substances and extractives
Recommendation for 13-epimanool usage levels up to:
	not for fragrance use.

Recommendation for 13-epimanool flavor usage levels up to:
	not for flavor use.

Safety References:

EPI System: View

AIDS Citations:Search

Cancer Citations:Search

Toxicology Citations:Search

EPA ACToR:Toxicology Data

EPA Substance Registry Services (SRS):Registry

Laboratory Chemical Safety Summary :91747954

National Institute of Allergy and Infectious Diseases:Data

5-[(1R,8aS)-4,4,8a-trimethyl-7-methylidene-2,3,4a,5,6,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol

References:

	5-[(1R,8aS)-4,4,8a-trimethyl-7-methylidene-2,3,4a,5,6,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol
NIST Chemistry WebBook:	Search Inchi
Pubchem (cid):	91747954
Pubchem (cas):	1438-62-6
Pherobase:	View

Other Information:

(IUPAC):	Atomic Weights of the Elements 2011 (pdf)
Videos:	The Periodic Table of Videos
tgsc:	Atomic Weights use for this web site
(IUPAC):	Periodic Table of the Elements
CHEBI:	View
HMDB (The Human Metabolome Database):	Search
Typical G.C.
VCF-Online:	VCF Volatile Compounds in Food

Potential Blenders and core components note

None Found

Potential Uses:

None Found

Occurrence (nature, food, other):note

	centaurea thessala ssp. drakiensis Search Trop Picture
	rhizophora mangle bark oil cuba @ 2.10% Data GC Search Trop Picture
	salvia officinalis seed oil tunisia @ 2.22% Data GC Search Trop Picture
	salvia sclarea seed oil tunisia @ 0.59% Data GC Search Trop Picture
	salvia verbenaca seed oil tunisia @ 5.61% Data GC Search Trop Picture

Synonyms:

13-epi-	manool
5-(5,5,8alpha-	trimethyl-2-methylene decahydro-1-naphthalenyl)-3-methyl-1-penten-3-ol
5-(5,5,8alpha-	trimethyl-2-methylenedecahydro-1-naphthalenyl)-3-methyl-1-penten-3-ol
5-[(1R,8aS)-4,4,8a-	trimethyl-7-methylidene-2,3,4a,5,6,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol

Articles:

PubMed:Chemical constituents of Abies delavayi.

PubMed:Phytochemicals from Cunninghamia konishii Hayata act as antifungal agents.

PubMed:Volatile composition of Catharanthus roseus (L.) G. Don using solid-phase microextraction and gas chromatography/mass spectrometry.

PubMed:Effect of nitrogen concentration of the nutrient solution on the volatile constituents of leaves of Salvia fruticosa Mill. in solution culture.

Notes:

None found

13-epimanool 5-(5,5,8alpha-trimethyl-2-methylene decahydro-1-naphthalenyl)-3-methyl-1-penten-3-ol

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Articles:

13-epimanool
5-(5,5,8alpha-trimethyl-2-methylene decahydro-1-naphthalenyl)-3-methyl-1-penten-3-ol