xanthotoxol geranyl ether, 7437-55-0

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CODE142760 CODE142760
Product(s):
7437-55-0 8-Geranyloxypsoralen

Name:	9-[(2E)-3,7-dimethylocta-2,6-dienoxy]furo[3,2-g]chromen-7-one
CAS Number:	7437-55-0	3D/inchi
FDA UNII:	Search
Nikkaji Web:	J1.210.783H
Beilstein Number:	313632
MDL:	MFCD03412052
XlogP3:	5.30 (est)
Molecular Weight:	338.40314000
Formula:	C21 H22 O4
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
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:	503.70 °C. @ 760.00 mm Hg (est)
Flash Point:	497.00 °F. TCC ( 258.40 °C. ) (est)
logP (o/w):	5.850 (est)
Soluble in:
	water, 0.034 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.

8-Geranyloxypsoralen

Sigma-Aldrich

For experimental / research use only.

8-Geranyloxypsoralen 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 xanthotoxol geranyl ether usage levels up to:
	not for fragrance use.

Recommendation for xanthotoxol geranyl ether 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 :5317564

National Institute of Allergy and Infectious Diseases:Data

WGK Germany:3

9-[(2E)-3,7-dimethylocta-2,6-dienoxy]furo[3,2-g]chromen-7-one

Chemidplus:0007437550

References:

	9-[(2E)-3,7-dimethylocta-2,6-dienoxy]furo[3,2-g]chromen-7-one
NIST Chemistry WebBook:	Search Inchi
Pubchem (cid):	5317564
Pubchem (sid):	135205669

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):	HMDB39309
FooDB:	FDB018859
VCF-Online:	VCF Volatile Compounds in Food
ChemSpider:	View
EFSA Update of results on the monitoring of furan levels in food:	Read Report
EFSA Previous report: Results on the monitoring of furan levels in food:	Read Report
EFSA Report of the CONTAM Panel on provisional findings on furan in food:	Read Report

Potential Blenders and core components note

None Found

Potential Uses:

None Found

Occurrence (nature, food, other):note

	citrus oils Search PMC Picture
	lemon fruit oil Search Trop Picture
	lemon oil Search Trop Picture
	lemon pericarp Search Trop Picture
	lime fruit Search Trop Picture

Synonyms:

9-{[(2E)-3,7-	dimethyl-2,6-octadien-1-yl]oxy}-7H-furo[3,2-g]chromen-7-one
(E)-9-((3,7-	dimethyl-2,6-octadienyl)oxy)-7H-furo(3,2-g)(1)benzopyran-7-one
9-((3,7-	dimethylocta-2,6-dien-1-yl)-oxy)-7H-furo[3,2-g]chromen-7-one
9-((3,7-	dimethylocta-2,6-dien-1-yl)oxy)-7H-furo[3,2-g]chromen-7-one
9-[(2E)-3,7-	dimethylocta-2,6-dienoxy]furo[3,2-g]chromen-7-one
9-((2E)-3,7-	dimethylocta-2,6-dienyloxy)furano[3,2-g]chromen-2-one
7H-	furo[3,2-g][1]benzopyran-7-one, 9-[[(2E)-3,7-dimethyl-2,6-octadien-1-yl]oxy]-
8-	geranyl oxypsoralen
8-	geranyloxy psoralen
8-	geranyloxypsoralen

Articles:

PubMed:Vasodilation and radical-scavenging activity of imperatorin and selected coumarinic and flavonoid compounds from genus Casimiroa.

PubMed:Structure-activity relationships for naturally occurring coumarins as β-secretase inhibitor.

PubMed:Nematicidal coumarins from Heracleum candicans Wall.

PubMed:Muscarinic receptor binding activity of polyoxygenated flavones from Melicope subunifoliolata.

PubMed:[Studies on chemical constituents in roots of Heracleum rapula].

PubMed:Synthesis of 8-geranyloxypsoralen analogues and their evaluation as inhibitors of CYP3A4.

Notes:

Constit. of lemon oil

xanthotoxol geranyl ether 8-geranyl oxypsoralen

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Articles:

xanthotoxol geranyl ether
8-geranyl oxypsoralen