6"-O-malonyl daidzin, 124590-31-4

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CODE168105 CODE168105
Product(s):
124590-31-4 6-O-Malonyldaidzin free acid

CAS Number:	124590-31-4	3D/inchi
FDA UNII:	54CE6OWE7A
Nikkaji Web:	J485.133A
MDL:	MFCD02684044
XlogP3-AA:	0.40 (est)
Molecular Weight:	502.42974000
Formula:	C24 H22 O12
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:	823.54 °C. @ 760.00 mm Hg (est)
Flash Point:	542.00 °F. TCC ( 283.50 °C. ) (est)
logP (o/w):	1.943 (est)
Soluble in:
	water, 2074 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.

6-O-Malonyldaidzin free acid

Carbosynth

For experimental / research use only.

6"-O-Malonyldaidzin free acid

Nacalai USA

For experimental / research use only.

6"-O-Malonyldaidzin

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 6"-O-malonyl daidzin usage levels up to:
	not for fragrance use.

Recommendation for 6"-O-malonyl daidzin 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 :9913968

National Institute of Allergy and Infectious Diseases:Data

3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]propanoic acid

Chemidplus:0124590314

References:

	3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]propanoic acid
NIST Chemistry WebBook:	Search Inchi
Pubchem (cid):	9913968
Pubchem (sid):	162259420

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
KEGG (GenomeNet):	C16191
HMDB (The Human Metabolome Database):	HMDB41263
FooDB:	FDB021174
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

	soybean plant Search Trop Picture
	soybean seed Search Trop Picture

Synonyms:

	daidzin 6''-O-malonate
6"-O-	malonyldaidzin
3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-	trihydroxy-6-[3-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]propanoic acid

Articles:

PubMed:Kudzu (Pueraria lobata) vine ethanol extracts improve ovariectomy-induced bone loss in female mice.

PubMed:Isoflavone content and its potential contribution to the antihypertensive activity in soybean Angiotensin I converting enzyme inhibitory peptides.

PubMed:Correlations of oil and protein with isoflavone concentration in soybean [Glycine max (L.) Merr.].

PubMed:Variation in isoflavone of soybean cultivars with location and storage duration.

PubMed:Isoflavone aglycon and glucoconjugate content of high- and low-soy U.K. foods used in nutritional studies.

PubMed:Preparative separation of isoflavone components in soybeans using high-speed counter-current chromatography.

Notes:

Present in soy foods; potential nutriceutical

6"-O-malonyl daidzin daidzin 6''-O-malonate

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Articles:

6"-O-malonyl daidzin
daidzin 6''-O-malonate