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yohimbic acid monohydrate
yohimban-16-carboxylic acid, 17-hydroxy-, (16alpha,17alpha)- (9CI)

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Name:(1S,15R,18S,19R,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylic acid
CAS Number: 522-87-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:208-337-7
FDA UNII: 35FAV1EVEG
Nikkaji Web:J6.627C
Beilstein Number:0096991
MDL:MFCD00167087
XlogP3:0.30 (est)
Molecular Weight:340.42288000
Formula:C20 H24 N2 O3
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: 600.00 °C. @ 760.00 mm Hg (est)
Flash Point: 602.00 °F. TCC ( 316.60 °C. ) (est)
logP (o/w): 1.940 (est)
Soluble in:
 water, 901.7 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.
Yohimbic Acid >95%
Odor: characteristic
Use: Yohimbic acid is found in the barks of Pausinystalia johimbe.
 
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 yohimbic acid monohydrate usage levels up to:
 not for fragrance use.
 
Recommendation for yohimbic acid monohydrate 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 :72131
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
(1S,15R,18S,19R,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylic acid
Chemidplus:0000522872
 
References:
 (1S,15R,18S,19R,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylic acid
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):72131
Pubchem (sid):135029766
 
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
CHEBI:View
CHEMBL:View
HMDB (The Human Metabolome Database):Search
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 found in nature
 
Synonyms:
(1S,15R,18S,19R,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylic acid
17alpha-hydroxyyohimban-16alpha-carboxylic acid
 yohimban-16-carboxylic acid, 17-hydroxy-, (16alpha,17alpha)- (9CI)
 yohimbinic acid
 

Articles:

PubMed:Indole alkaloids and other constituents of Rauwolfia serpentina.
PubMed:Sub-nanogram analysis of yohimbine and related compounds by high-performance liquid chromatography.
PubMed:Contribution of side-chain chromophores to the optical activity of proteins: Model compound studies. IV. The indole chromophore of yohimbinic acid.
PubMed:[ON THE SUCCESSIVE STAGES OF THE SYMPATHICOLYTIC ACTIVITY OF YOHIMBIC ACID].
PubMed:[EEG study of the central action of yohimbine and yohimbic acid. (Experimental research)].
PubMed:[Demonstration of the direct vasodilatory action of yohimbic acid and Py-tetrahydroquinoline].
PubMed:[Pharmacological studies on yohimbic acid ethyl ester (A 38) and 4-=2-(p-butoxyphenyl)-1,3-dioxolan-2-ylmethyl=-morpholine methobromide (Q 160) as well as the influence of these substances on reserpine action].
PubMed:[Sympatholytic activity and toxicity of an amphoteric demethylated derivative of yohimbine: yohimbic acid].
 
Notes:
None found
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