EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

aristolone
(1aalpha,7alpha,7aalpha, 7balpha)- 1,1a,4,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-2H-cyclopropa(a)naphthalen-2-one

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CAS Number: 6831-17-0Picture of molecule3D/inchi
Nikkaji Web:J17.033J
XlogP3-AA:3.60 (est)
Molecular Weight:218.33954000
Formula:C15 H22 O
BioActivity Summary:listing
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
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 306.00 to 307.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.001000 mmHg @ 25.00 °C. (est)
Flash Point: 277.00 °F. TCC ( 136.11 °C. )
logP (o/w): 3.873 (est)
Soluble in:
 alcohol
 water, 3.638 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.
Aristolone
Odor: characteristic
Use: Aristolone is isolated from the herbs of Aristolochia debilis Sieb. et Zucc.
 
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 aristolone usage levels up to:
 not for fragrance use.
 
Recommendation for aristolone flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :165536
National Institute of Allergy and Infectious Diseases:Data
(1aR,7R,7aR,7bS)-1,1,7,7a-tetramethyl-1a,4,5,6,7,7b-hexahydrocyclopropa[a]naphthalen-2-one
Chemidplus:0006831170
 
References:
 (1aR,7R,7aR,7bS)-1,1,7,7a-tetramethyl-1a,4,5,6,7,7b-hexahydrocyclopropa[a]naphthalen-2-one
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):165536
Pubchem (sid):135120244
Pherobase:View
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
CHEMBL:View
HMDB (The Human Metabolome Database):HMDB12108
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
RSC Learn Chemistry:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 patchouli oil china @ 0.85%
Data GC Search Trop Picture
 snake root oil canada @ 0.90%
Data GC Search Trop Picture
 
Synonyms:
(1aalpha,7alpha,7aalpha, 7balpha)- 1,1a,4,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-2H-cyclopropa(a)naphthalen-2-one
(1aR,7R,7aR,7bS)-1,1,7,7a-tetramethyl-1a,4,5,6,7,7b-hexahydrocyclopropa[a]naphthalen-2-one
 

Articles:

PubMed:HPTLC and reverse phase HPLC methods for the simultaneous quantification and in vitro screening of antioxidant potential of isolated sesquiterpenoids from the rhizomes of Cyperus rotundus.
PubMed:Inhibitory effects of wild dietary plants on lipid peroxidation and on the proliferation of human cancer cells.
PubMed:Chemical constituents of essential oils from the leaves, stems, roots and fruits of Alpinia polyantha.
PubMed:Terpenoids from Russula lepida and R. amarissima (Basidiomycota, Russulaceae).
PubMed:New bioactive secondary metabolites from Bornean red alga, Laurencia similis (Ceramiales).
PubMed:Disesquiterpene and sesquiterpene coumarins from Ferula pseudalliacea, and determination of their absolute configurations.
PubMed:A novel brominated cuparene-derived sesquiterpene ether from the red alga Laurencia sp.
PubMed:Chemical analysis and biological activity of the essential oils of two valerianaceous species from China: Nardostachys chinensis and Valeriana officinalis.
PubMed:Revision of the absolute configuration at C(23) of lanostanoids and isolation of secondary metabolites from formosan soft coral Nephthea erecta.
PubMed:Bioactive and other sesquiterpenoids from Porella cordeana.
PubMed:Sesquiterpenes from the sponge Axinyssa isabela.
PubMed:Isothiocyanate sesquiterpenes from a sponge of the genus axinyssa.
PubMed:Terpenoid-related metabolites from a formosan soft coral Nephthea chabrolii.
PubMed:Modulation of radioligand binding to the GABA(A)-benzodiazepine receptor complex by a new component from Cyperus rotundus.
PubMed:[GC-MS analysis of essential oils from roots and vines of Aristochia and their allied drugs].
 
Notes:
Isolated from roots and vines of Aristochiaisolated from roots and vines of aristochia.
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