isatidine
senecionan-11,16-dione, 12,18-dihydroxy-, 4-oxide (9CI)
 
Notes:
None found
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CAS Number: 15503-86-3Picture of molecule3D/inchi
Other: 547-04-6
FDA UNII: 51819GRV4U
Beilstein Number: 0058804
MDL: MFCD00150878
Molecular Weight: 367.39865000
Formula: C18 H25 N O7
NMR Predictor: Predict (works with chrome or firefox)
Category: natural substances and extractives
 
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Soluble in:
 water, 3.56e+004 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
Sigma-Aldrich: Sigma
For experimental / research use only.
Retrorsine N-oxide dihydrate
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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:
intravenous-mouse LD50  835 mg/kg
BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Pharmacology and Experimental Therapeutics. Vol. 75, Pg. 83, 1942.

intraperitoneal-rat LD50  250 mg/kg
LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA LIVER: OTHER CHANGES
Chemico-Biological Interactions. Vol. 5, Pg. 227, 1972.

oral-rat LD50  48 mg/kg
LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA LIVER: OTHER CHANGES
Chemico-Biological Interactions. Vol. 5, Pg. 227, 1972.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: natural substances and extractives
Recommendation for isatidine usage levels up to:
 not for fragrance use.
 
Recommendation for isatidine flavor usage levels up to:
 not for flavor use.
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Safety References:
European Food Safety Authority (EFSA) reference(s):
Dietary exposure assessment to pyrrolizidine alkaloids in the European population
View page or View pdf
EPI System: View
Chemical Carcinogenesis Research Information System: Search
AIDS Citations: Search
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Toxicology Citations: Search
Carcinogenic Potency Database: Search
EPA GENetic TOXicology: Search
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 76972338
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 3
Chemidplus: 0015503863
RTECS: VH7700000 for cas# 15503-86-3
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References:
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 76972338
Pubchem (sid): 134992843
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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
HMDB (The Human Metabolome Database): Search
VCF-Online: VCF Volatile Compounds in Food
Wikipedia: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 senecio vulgaris
Search Trop  Picture
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Synonyms:
12,18-dihydroxysenecionan-11,16-dione-4-oxide
trans-15-ethylidene-12beta-hydroxy-12alpha-hydroxymethyl-13beta-methylsenec-1-enine-4-oxide
cis-retronecic acid ester of retronecine-n-oxide
 retrorsine N-oxide
 retrorsine-N-oxide
 senecionan-11,16-dione, 12,18-dihydroxy-, 4-oxide (9CI)
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