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

heraclenin
prengenine

Supplier Sponsors

Name:9-[[(2R)-3,3-dimethyloxiran-2-yl]methoxy]furo[3,2-g]chromen-7-one
CAS Number: 2880-49-1Picture of molecule3D/inchi
Other(deleted CASRN):23459-97-4
FDA UNII: G71S84CX12
Nikkaji Web:J14.592K
XlogP3:2.20 (est)
Molecular Weight:286.28358000
Formula:C16 H14 O5
BioActivity Summary:listing
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
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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: 471.39 °C. @ 760.00 mm Hg (est)
Flash Point: 462.00 °F. TCC ( 238.90 °C. ) (est)
logP (o/w): 1.680 (est)
Soluble in:
 water, 97.9 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Alfa Biotechnology
For experimental / research use only.
Heraclenin 98%
BOC Sciences
For experimental / research use only.
Heraclenin 0.985
Odor: characteristic
Use: Heraclenin isolated from the fruits of Citrus aurantium L. It induces apoptosis in Jurkat leukemia cells. anti-inflammatory;
Coompo
For experimental / research use only.
Heraclenin from Plants ≥96%
Santa Cruz Biotechnology
For experimental / research use only.
Heraclenin
 
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 heraclenin usage levels up to:
 not for fragrance use.
 
Recommendation for heraclenin flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
Chemical Carcinogenesis Research Information System:Search
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA GENetic TOXicology:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :458010
National Institute of Allergy and Infectious Diseases:Data
9-[[(2R)-3,3-dimethyloxiran-2-yl]methoxy]furo[3,2-g]chromen-7-one
Chemidplus:0002880491
 
References:
 9-[[(2R)-3,3-dimethyloxiran-2-yl]methoxy]furo[3,2-g]chromen-7-one
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):458010
Pubchem (sid):134982609
 
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
CHEMBL:View
HMDB (The Human Metabolome Database):Search
FooDB:FDB005034
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 carrot root
Search Trop Picture
 lemon fruit oil
Search Trop Picture
 
Synonyms:
(R)-9-((3,3-dimethyl oxiranyl)methoxy)-7H-furo(3,2-g)(1)benzopyran-7-one
9-[[(2R)-3,3-dimethyloxiran-2-yl]methoxy]furo[3,2-g]chromen-7-one
7H-furo(3,2-g)(1)benzopyran-7-one, 9-((3,3-dimethyloxiranyl)methoxy)-, (R)- (9CI)
7H-furo(3,2-g)(1)benzopyran-7-one, 9-(2,3-epoxy-3-methylbutoxy)-, (R)-(+)-
 prangenin
 prengenine
 

Articles:

PubMed:Simultaneous determination of imperatorin and its metabolites in vitro and in vivo by a GC-MS method: application to a bioavailability and protein binding ability study in rat plasma.
PubMed:In vitro and in vivo antiproliferative effect of a combination of ultraviolet-A and alkoxy furocoumarins isolated from Umbelliferae medicinal plants, in melanoma cells.
PubMed:Phytotoxic furanocoumarins from the shoots of Semenovia transiliensis.
PubMed:Vasorelaxation by extracts of Casimiroa spp. in rat resistance vessels and pharmacological study of cellular mechanisms.
PubMed:Coumarins from Angelica lucida L.--antibacterial activities.
PubMed:Nematicidal coumarins from Heracleum candicans Wall.
PubMed:Imperatorin inhibits T-cell proliferation by targeting the transcription factor NFAT.
PubMed:Candibirin A, a furanocoumarin dimer isolated from Heracleum candicans WALL.
PubMed:Coumarins from Opopanax chironium. New dihydrofuranocoumarins and differential induction of apoptosis by imperatorin and heraclenin.
PubMed:HPLC-NMR/HPLC-MS analysis of the bark extract of Stauranthus perforatus.
PubMed:Coumarins from the aerial part of Halocnemum strobilaceum.
PubMed:Cytotoxic components from the bark of Stauranthus perforatus from Monteverde, Costa Rica.
PubMed:Anti-inflammatory activity of coumarins from Decatropis bicolor on TPA ear mice model.
PubMed:Chromosome-damaging effects of heraclenin in human lymphocytes in vitro.
PubMed:Mutagenicity of a furocoumarin epoxide, heraclenin, in Chlamydomonas reinhardii.
PubMed:The mutagenicities of seven coumarin derivatives and a furan derivative (nimbolide) isolated from three medicinal plants.
PubMed:The possible role of tropical medicinal preparations in human carcinoma in Africa.
PubMed:Inhaltsstoffe aus Wurzelrinde und Stammholz von Afraegle paniculata1,2.
PubMed:Anticoagulant activity of Heraclenin.
 
Notes:
from chlamydomonas reinhardii.
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