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Flavonoids

Ladanein

5,6-二羟基-7,4'-二甲氧基黄酮

PHY-NP-17381 · Natural product research catalog

Catalog numberPHY-NP-17381
CAS number10176-71-3
Molecular formulaC17H14O6
Molecular weight314.293 g/mol
Chemical classFlavonoids
Main reported sourceSalvia cyanescens
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of Ladanein

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Product information

Ladanein is listed in the Flavonoids 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 name5,6-dihydroxy-7-methoxy-2-(4-methoxyphenyl)chromen-4-one
SMILESCOC1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)O)O
InChIKeyUUQJTIHOVGMQIH-UHFFFAOYSA-N
Subclass / scaffoldFlavones
PubChem CID3084066

Computed properties

Exact mass (Da)314.079Predicted LogP2.8884
Predicted TPSA (Ų)89.13H-bond donors2
H-bond acceptors6Rotatable bonds3

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

View additional properties & classification
Ring count3
Aromatic rings3
Fraction Csp³0.118
Synthetic accessibility score2.22
QED score0.723
Lipinski rule violations0
NPClassifier pathwayShikimates and Phenylpropanoids
NPClassifier superclassFlavonoids
NPClassifier classFlavones
Parent SMILESCOc1ccc(-c2cc(=O)c3c(O)c(O)c(OC)cc3o2)cc1
Parent formulaC17H14O6
Parent molecular weight314.293
Specified stereocenters0
Unspecified stereocenters0

Reported natural occurrence

Main reported sourceSalvia cyanescens
Reported source familiesLamiaceae; Asteraceae; Orobanchaceae

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

View occurrence records & references
LOTUS / Wikidata speciesSalvia cyanescens[4]; Marrubium vulgare[3]; Marrubium trachyticum[2]; Marrubium velutinum[2]; Mentha piperita[2]; Mentha pulegium[2]; Orthosiphon aristatus[2]; Orthosiphon grandiflorus[2]; Salvia hypoleuca[2]; Salvia stenophylla[2]; Salvia syriaca[2]; basil[2]; Artemisia argyi[1]; Baccharis tucumanensis[1]; Ballota hirsuta[1]
All reported source familiesLamiaceae[35]; Asteraceae[3]; Orobanchaceae[2]; Apidae[1]
Genus / family recordsApis[1]
LOTUS species records40
LOTUS reference records38
COCONUT occurrence recordsAbies veitchii; Ainsliaea macrocephala; Angelica ursina; Aphis sambuci; Apis; Ardisia macrocarpa; Artemisia argyi; Artemisia aygyi; Asplenium nidus; Asterias rubens; Astragalus inopinatus; Baccharis tucumanensis; Ballota hirsuta; Ballota saxatilis; Bidens tripartita; Boronia ternata; Buxus hyrcana; Buxus microphylla; Casearia membranacea; Catalpa bignonioides; Celmisia petriei; Cephalaria ambrosioides; Chlorophytum malayense; Chroogomphus rutilus; Cinnamomum kotoense; Cirsium helenioides; Clausena indica; Clerodendranthus spicatus; Clinopodium albanicum; Clinopodium album
COCONUT organism records131
COCONUT identifierCNP0279844.0

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.