Articles:
(3S-(3alpha,6alpha(R*)))-tetrahydro-2,2,6-trimethyl-6-(4-methyl-3-cyclohexen-1-yl)-2H-pyran-3-ol
Notes:
induces apoptosis in rat thymocytes; from german chamomile (matricaria recutita l.). Constit. of Matricaria chamomilla (German chamomile)
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| CAS Number: | 22567-36-8 |  3D/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 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:
| Preferred SDS: View | |
| 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 |