populin, 99-17-2

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CODE158866 CODE158866
Product(s):
99-17-2 Populin

Name:	[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-(hydroxymethyl)phenoxy]oxan-2-yl]methyl benzoate
CAS Number:	99-17-2	3D/inchi
ECHA EINECS - REACH Pre-Reg:	202-737-5
FDA UNII:	XC8BY5AX02
Nikkaji Web:	J4.964F
XlogP3:	0.50 (est)
Molecular Weight:	390.38894000
Formula:	C20 H22 O8
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
Melting Point:	180.00 °C. @ 760.00 mm Hg
Boiling Point:	612.20 °C. @ 760.00 mm Hg (est)
Flash Point:	423.00 °F. TCC ( 217.20 °C. ) (est)
logP (o/w):	2.050 (est)
Soluble in:
	water, 500 mg/L @ 25 °C (exp)
	water, 685 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.

Populin

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 populin usage levels up to:
	not for fragrance use.

Recommendation for populin 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 :92735

National Institute of Allergy and Infectious Diseases:Data

[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-(hydroxymethyl)phenoxy]oxan-2-yl]methyl benzoate

Chemidplus:0000099172

References:

	[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-(hydroxymethyl)phenoxy]oxan-2-yl]methyl benzoate
NIST Chemistry WebBook:	Search Inchi
Pubchem (cid):	92735
Pubchem (sid):	135051335

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
KEGG (GenomeNet):	C10823
HMDB (The Human Metabolome Database):	Search
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

	poplar black poplar Search Trop Picture
	populus tomentosa leaf Search Trop Picture

Synonyms:

beta-D-	glucopyranoside, 2-(hydroxymethyl)phenyl, 6-benzoate (9CI)
2-(	hydroxymethyl) phenyl-beta-dextro-glucopyranoside 6-benzoate
2-(	hydroxymethyl)phenyl-beta-D-glucopyranoside 6-benzoate
	populine
	populoside
	salicin 6'-benzoate
[(2R,3S,4S,5R,6S)-3,4,5-	trihydroxy-6-[2-(hydroxymethyl)phenoxy]oxan-2-yl]methyl benzoate

Articles:

PubMed:Synthesis of acyl derivatives of salicin, salirepin, and arbutin.

PubMed:(1)H, (15)N and (13)C resonance assignment of cerato-populin, a fungal PAMP from Ceratocystis populicola.

PubMed:Differential timing of defense-related responses induced by cerato-platanin and cerato-populin, two non-catalytic fungal elicitors.

PubMed:Cerato-populin and cerato-platanin, two non-catalytic proteins from phytopathogenic fungi, interact with hydrophobic inanimate surfaces and leaves.

PubMed:Antioxidant phenolic glycosides from the bark of Populus ussuriensis Kom.

PubMed:New proteins orthologous to cerato-platanin in various Ceratocystis species and the purification and characterization of cerato-populin from Ceratocystis populicola.

PubMed:Phenolic compounds in the leaves of Populus ussuriensis and their antioxidant activities.

Notes:

from chinese white poplar (populus tomentosa) leaf.

populin beta-D-glucopyranoside, 2-(hydroxymethyl)phenyl, 6-benzoate (9CI)

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Articles:

populin
beta-D-glucopyranoside, 2-(hydroxymethyl)phenyl, 6-benzoate (9CI)