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alpha-bisabolol oxide A
(3S-(3alpha,6alpha(R*)))-tetrahydro-2,2,6-trimethyl-6-(4-methyl-3-cyclohexen-1-yl)-2H-pyran-3-ol

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Name:2,2,6-trimethyl-6-(4-methylcyclohex-3-en-1-yl)oxan-3-ol
CAS Number: 22567-36-8Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:245-086-2
FDA UNII: 16AE65F94Y
Nikkaji Web:J296.934C
MDL:MFCD10567365
XlogP3-AA:2.50 (est)
Molecular Weight:238.37062000
Formula:C15 H26 O2
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
Boiling Point: 327.00 to 328.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.000015 mmHg @ 25.00 °C. (est)
Flash Point: 259.00 °F. TCC ( 125.90 °C. ) (est)
logP (o/w): 3.457 (est)
Soluble in:
 alcohol
 water, 21.49 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Bisabolol oxide A >95%
Odor: characteristic
Use: Bisabolol oxide A is found in the herbs of Matricaria chamomilla.
Santa Cruz Biotechnology
For experimental / research use only.
alpha-Bisabolol Oxide A
Sigma-Aldrich
For experimental / research use only.
Bisabolol Oxide A
analytical standard
 
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 alpha-bisabolol oxide A usage levels up to:
 not for fragrance use.
 
Recommendation for alpha-bisabolol oxide A 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 :90806
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
2,2,6-trimethyl-6-(4-methylcyclohex-3-en-1-yl)oxan-3-ol
Chemidplus:0022567368
 
References:
 2,2,6-trimethyl-6-(4-methylcyclohex-3-en-1-yl)oxan-3-ol
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):90806
Pubchem (sid):135049521
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
KEGG (GenomeNet):C16773
HMDB (The Human Metabolome Database):HMDB38196
FooDB:FDB017435
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 chamomile
Search Trop Picture
 chamomile garden chamomile plant
Search Trop Picture
 chamomile roman chamomile
Search Trop Picture
 chamomile sweet false chamomile
Search Trop Picture
 chamomile sweet false chamomile plant
Search Trop Picture
 lavender cotton lavender
Search Trop Picture
 matricaria chamomilla flower oil @ 57.68%
Data GC Search Trop Picture
 
Synonyms:
 bisabolol oxide A
2H-pyran-3-ol, tetrahydro-2,2,6-trimethyl-6-(4-methyl-3-cyclohexen-1-yl)-
 tetrahydro-2,2,6-trimethyl-6-(4-methyl-3-cyclohexen-1-yl)-2H-pyran-3-ol
(3S-(3alpha,6alpha(R*)))-tetrahydro-2,2,6-trimethyl-6-(4-methyl-3-cyclohexen-1-yl)-2H-pyran-3-ol
2,2,6-trimethyl-6-(4-methyl-3-cyclohexen-1-yl)tetrahydro-2H-pyran-3-ol
2,2,6-trimethyl-6-(4-methylcyclohex-3-en-1-yl)oxan-3-ol
 

Articles:

PubMed:Antihyperalgesic and antiedematous activities of bisabolol-oxides-rich matricaria oil in a rat model of inflammation.
PubMed:Fast quality assessment of German chamomile (Matricaria chamomilla L.) by headspace solid-phase microextraction: influence of flower development stage.
PubMed:Control of Tetranychus urticae Koch by extracts of three essential oils of chamomile, marjoram and Eucalyptus.
PubMed:Psychopharmacological profile of Chamomile (Matricaria recutita L.) essential oil in mice.
PubMed:Effect of Matricaria chamomilla L. flower essential oil on the growth and ultrastructure of Aspergillus niger van Tieghem.
PubMed:alpha-bisabololoxide derivatives from Artemisia abrotanum.
 
Notes:
induces apoptosis in rat thymocytes; from german chamomile (matricaria recutita l.). Constit. of Matricaria chamomilla (German chamomile)
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