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Polyketides

Orcinol Glucoside

苔黑酚葡萄糖苷

PHY-NP-11857 · Natural product research catalog

Catalog numberPHY-NP-11857
CAS number21082-33-7
Molecular formulaC13H18O7
Molecular weight286.28 g/mol
Chemical classPolyketides
Main reported sourceCurculigo capitulata
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of Orcinol Glucoside

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Product information

Orcinol Glucoside is listed in the Polyketides 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.

Names & identifiers

IUPAC name(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(3-hydroxy-5-methylphenoxy)oxane-3,4,5-triol
SMILESCC1=CC(=CC(=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O
InChIKeyYTXIGTCAQNODGD-UJPOAAIJSA-N
PubChem CID12315192

Computed properties

Exact mass (Da)286.1053Predicted LogP-1.1207
Predicted TPSA (Ų)119.61H-bond donors5
H-bond acceptors7Rotatable bonds3

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

View additional properties & classification
Ring count2
Aromatic rings1
Fraction Csp³0.538
Synthetic accessibility score3.58
QED score0.477
Lipinski rule violations0
NPClassifier pathwayPolyketides
Parent SMILESCc1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Parent formulaC13H18O7
Parent molecular weight286.28
Specified stereocenters5
Unspecified stereocenters0

Reported natural occurrence

Main reported sourceCurculigo capitulata
Reported source familiesHypoxidaceae; Asteraceae

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

View occurrence records & references
LOTUS / Wikidata speciesCurculigo capitulata[2]; Curculigo orchioides[2]; Helichrysum arenarium[2]; Curculigo breviscapa[1]
All reported source familiesHypoxidaceae[3]; Asteraceae[1]
LOTUS species records4
LOTUS reference records7
COCONUT occurrence recordsCurculigo breviscapa; Curculigo capitulata; Curculigo orchioides; Helichrysum arenarium; Hippomarathrum cristatum; Molineria capitulata; Pachycereus weberi
COCONUT organism records7
COCONUT identifierCNP0149045.1

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

Documents & specifications

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

Request applicable documentation and handling information before ordering or use.