Phenols

Arbutin

熊果苷

PHY-NP-15584 · Natural product research catalog

Catalog number	PHY-NP-15584
CAS number	497-76-7
Molecular formula	C₁₂H₁₆O₇
Molecular weight	272.253 g/mol
Chemical class	Phenols
Main reported source	Arctostaphylos uva-ursi
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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Arbutin is listed in the Phenols section of the Phytide Bio research catalog. Standard pack sizes are 5, 10, 20, 50 and 100 mg.

For research use only. Not for human or veterinary use, diagnosis or treatment.

IUPAC name	(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)oxane-3,4,5-triol
SMILES	C1=CC(=CC=C1O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O
InChIKey	BJRNKVDFDLYUGJ-RMPHRYRLSA-N
Subclass / scaffold	酚羟基×1
PubChem CID	440936

Calculated values from the supplied dataset; not measured batch specifications.

View additional properties & classification

Ring count	2
Aromatic rings	1
Fraction Csp³	0.5
Synthetic accessibility score	3.33
QED score	0.457
Lipinski rule violations	0
NPClassifier pathway	Shikimates and Phenylpropanoids
Parent SMILES	OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Parent formula	C₁₂H₁₆O₇
Parent molecular weight	272.253
Specified stereocenters	5
Unspecified stereocenters	0

Main reported source	Arctostaphylos uva-ursi
Reported source families	Ericaceae; Asteraceae; Fabaceae

Reported natural occurrence does not establish the manufacturing origin of the supplied material.

View occurrence records & references

LOTUS / Wikidata species	Arctostaphylos uva-ursi[10]; Arctostaphylos columbiana[2]; Arctostaphylos patula[2]; Escherichia coli[2]; Mutisia acuminata[2]; Myrothamnus flabellifolia[2]; Myrothamnus flabellifolius[2]; Myrsine seguinii[2]; Onobrychis arenaria[2]; Pyrus communis[2]; Rhodiola sacra[2]; Aesculus californica[1]; Antennaria microphylla[1]; Arbutus andrachne[1]; Arbutus unedo[1]
All reported source families	Ericaceae[16]; Asteraceae[11]; Fabaceae[10]; Crassulaceae[6]; Rosaceae[4]; Adoxaceae[4]
Genus / family records	Thalassotalea[1]
LOTUS species records	91
LOTUS reference records	90
COCONUT occurrence records	Achillea spinulifolia; Aesculus californica; Afrocarpus gracilior; Agave xylonacantha; Albizia procera; Allium waldsteinii; Alnus incana; Amaroria soulameoides; Ambrosia hispida; Anacardium occidentale; Angelica furcijuga KITAGAWA; Antennaria microphylla; Antennaria sp.; Anthemis cretica; Antidesma pentandrum; Antiphiona pinnatisecta; Aplophyllum villosum; Arbutus andrachne; Arbutus sp.; Arbutus unedo; Archaster typicus; Arctostaphylos canescens; Arctostaphylos columbiana; Arctostaphylos nevadensis; Arctostaphylos patula; Arctostaphylos sp.; Arctostaphylos uva-ursi; Arctostaphylos uve-ursi (L.) Spreng.; Arctostaphylos viscida; Artocarpus altilis
COCONUT organism records	273
COCONUT identifier	CNP0370542.1
Source reference DOI(s)	10.1017/CBO9781107252806.053

Records are inherited from the supplied dataset and are not independently verified. Taxonomic names may include synonyms.

Certificate of analysis (COA)	Batch-specific COA available on request; no PDF published yet
Safety data sheet (SDS)	Not yet published
Storage / solubility	Product-specific conditions to be confirmed
Shipping	Confirmed with the quotation

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