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Anthraquinones

Anthrone

蒽酮

PHY-NP-15374 · Natural product research catalog

Catalog numberPHY-NP-15374
CAS number90-44-8
Molecular formulaC14H10O
Molecular weight194.233 g/mol
Chemical classAnthraquinones
Main reported sourceAspergillus fumigatus
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of Anthrone

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10 mgRequest quoteTo be confirmedConfirm in quotation
20 mgRequest quoteTo be confirmedConfirm in quotation
50 mgRequest quoteTo be confirmedConfirm in quotation
100 mgRequest quoteTo be confirmedConfirm in quotation

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Product information

Anthrone is listed in the Anthraquinones 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 name10H-anthracen-9-one
SMILESC1C2=CC=CC=C2C(=O)C3=CC=CC=C31
InChIKeyRJGDLRCDCYRQOQ-UHFFFAOYSA-N
Subclass / scaffoldAnthraquinones and anthrones
PubChem CID7018

Computed properties

Exact mass (Da)194.0732Predicted LogP2.8218
Predicted TPSA (Ų)17.07H-bond donors0
H-bond acceptors1Rotatable bonds0

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

View additional properties & classification
Ring count3
Aromatic rings2
Fraction Csp³0.071
Synthetic accessibility score1.68
QED score0.537
Lipinski rule violations0
NPClassifier pathwayPolyketides
NPClassifier superclassPolycyclic aromatic polyketides
NPClassifier classAnthraquinones and anthrones
Parent SMILESO=C1c2ccccc2Cc2ccccc21
Parent formulaC14H10O
Parent molecular weight194.233
Specified stereocenters0
Unspecified stereocenters0

Reported natural occurrence

Main reported sourceAspergillus fumigatus
Reported source familiesAspergillaceae

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

View occurrence records & references
LOTUS / Wikidata speciesAspergillus fumigatus[1]
All reported source familiesAspergillaceae[1]
LOTUS species records1
LOTUS reference records1
COCONUT occurrence recordsAspergillus fumigatus; Rheum coreanum; Rheum officinale; Rheum palmatum; Rheum tanguticum
COCONUT organism records5
COCONUT identifierCNP0144348.0

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.