3-hydroxy-4-pentene nitrile
4-pentenenitrile, 3-hydroxy-
 
Notes:
Potential neutriceutical
Synonyms   Articles   Notes   Search
CAS Number: 27451-36-1Picture of molecule3D/inchi
Nikkaji Web: J100.662B
MDL: MFCD00870334
XlogP3-AA: -0.10 (est)
Molecular Weight: 97.11699000
Formula: C5 H7 N 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
PubMed: Search
NCBI: Search
Synonyms   Articles   Notes   Search   Top
Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 247.00 °C. @ 760.00 mm Hg (est)
Flash Point: 218.00 °F. TCC ( 103.20 °C. ) (est)
logP (o/w): -0.040 (est)
Soluble in:
 water, 1.281e+005 mg/L @ 25 °C (est)
Synonyms   Articles   Notes   Search   Top
Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
Synonyms   Articles   Notes   Search   Top
Cosmetic Information:
None found
Synonyms   Articles   Notes   Search   Top
Suppliers:
 None found
Synonyms   Articles   Notes   Search   Top
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:
oral-rat LD50  200 mg/kg
BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)
Journal of Agricultural and Food Chemistry. Vol. 39, Pg. 311, 1991.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
Synonyms   Articles   Notes   Search   Top
Safety in Use Information:
Category: natural substances and extractives
Recommendation for 3-hydroxy-4-pentene nitrile usage levels up to:
 not for fragrance use.
 
Recommendation for 3-hydroxy-4-pentene nitrile flavor usage levels up to:
 not for flavor use.
Synonyms   Articles   Notes   Search   Top
Safety References:
EPI System: View
Cancer Citations: Search
Toxicology Citations: Search
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 91586
National Institute of Allergy and Infectious Diseases: Data
 3-hydroxypent-4-enenitrile
Chemidplus: 0027451361
Synonyms   Articles   Notes   Search   Top
References:
 3-hydroxypent-4-enenitrile
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 91586
Pubchem (sid): 135056989
Synonyms   Articles   Notes   Search   Top
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): HMDB31339
FooDB: FDB003403
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
Synonyms   Articles   Notes   Search   Top
Potential Blenders and core components note
 
None Found
 
Synonyms   Articles   Notes   Search   Top
Potential Uses:
None Found
Synonyms   Articles   Notes   Search   Top
Occurrence (nature, food, other): note
 found in nature
Synonyms   Articles   Notes   Search   Top
Synonyms:
1-cyano-2-hydroxy-3-butene
3-hydroxy-4-pentenenitrile
3-hydroxypent-4-enenitrile
4-pentenenitrile, 3-hydroxy-
Synonyms   Articles   Notes   Search   Top
Articles:
PubMed: Could nitrile derivatives of turnip (Brassica rapa) glucosinolates be hepato- or Cholangiotoxic in cattle?
PubMed: Biomarkers of exocrine pancreatic injury in 2 rat acute pancreatitis models.
PubMed: Metabonomic investigations into the global biochemical sequelae of exposure to the pancreatic toxin 1-cyano-2-hydroxy-3-butene in the rat.
PubMed: Induction of apoptosis by crambene protects mice against acute pancreatitis via anti-inflammatory pathways.
PubMed: Identification of novel peptide safety markers for exocrine pancreatic toxicity induced by cyanohydroxybutene.
PubMed: Evaluation of two novel peptide safety markers for exocrine pancreatic toxicity.
PubMed: Crambene induces pancreatic acinar cell apoptosis via the activation of mitochondrial pathway.
PubMed: Synergy among phytochemicals within crucifers: does it translate into chemoprotection?
PubMed: Crambene, a bioactive nitrile derived from glucosinolate hydrolysis, acts via the antioxidant response element to upregulate quinone reductase alone or synergistically with indole-3-carbinol.
PubMed: The cruciferous nitrile crambene has bioactivity similar to sulforaphane when administered to Fischer 344 rats but is far less potent in cell culture.
PubMed: Rapid isolation and purification of 1-cyano-2-hydroxy-3-butene (crambene) from Crambe abyssinica seed meal using immiscible solvent extraction and high-performance liquid chromatography.
PubMed: The synergistic upregulation of phase II detoxification enzymes by glucosinolate breakdown products in cruciferous vegetables.
PubMed: Preparation and biological activity of four epiprogoitrin myrosinase-derived products.
PubMed: Induction of rat pancreatic glutathione S-transferase and quinone reductase activities by a mixture of glucosinolate breakdown derivatives found in Brussels sprouts.
PubMed: Induction of apoptosis in pancreatic acinar cells reduces the severity of acute pancreatitis.
PubMed: The cruciferous nitrile, crambene, induces rat hepatic and pancreatic glutathione S-transferases.
PubMed: A comparison of the individual and collective effects of four glucosinolate breakdown products from brussels sprouts on induction of detoxification enzymes.
PubMed: Studies on the toxic effects of crambe meal and two of its constituents, 1-cyano-2-hydroxy-3-butene (CHB) and epi-progoitrin, in broiler chick diets.
PubMed: Differential effect of cyanohydroxybutene on glutathione synthesis in liver and pancreas of male rats.
PubMed: Differential effects of cyanohydroxybutene and selenium on normal and neoplastic canine mammary cells in vitro.
PubMed: In vitro metabolism of cyanohydroxybutene: formation of a glutathione-S-transferase catalyzed product.
PubMed: Separation of the toxic and glutathione-enhancing effects of the naturally occurring nitrile, cyanohydroxybutene.
PubMed: The acute pancreatotoxic effects of the plant nitrile 1-cyano-2-hydroxy-3-butene.
PubMed: Enhancement of pancreatic and hepatic glutathione levels in rats during cyanohydroxybutene intoxication.
PubMed: The relationship of vehicle to target organ toxicology induced by the naturally occurring nitrile 1-cyano-2-hydroxy-3-butene.
PubMed: Selective pancreato-toxicity in the rat induced by the naturally occurring plant nitrile 1-cyano-2-hydroxy-3-butene.
PubMed: Studies on the effects of rapeseed meal on thyroid status of cattle, glucosinolate and iodine content of milk and other parameters.
PubMed: (S)- and (R)-1-cyano-2-hydroxy-3-butene from myrosinase hydrolysis of epi-progoitrin and progoitrin.
Synonyms   Articles   Notes   Search   Top
Please share your Comments.
Email Address:
 
 
 
 
Top of Page Home
Copyright © 1980-2020 Perflavory ™ Disclaimer Privacy Policy