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Chromones

2,5-Dimethyl-7-Hydroxychromone

7-羟基-2,5-二甲基色原酮

PHY-NP-13815 · Natural product research catalog

Catalog numberPHY-NP-13815
CAS number38412-47-4
Molecular formulaC11H10O3
Molecular weight190.198 g/mol
Chemical classChromones
Main reported sourceAloe arborescens
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of 2,5-Dimethyl-7-Hydroxychromone

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Product information

2,5-Dimethyl-7-Hydroxychromone is listed in the Chromones 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 name7-hydroxy-2,5-dimethylchromen-4-one
SMILESCC1=CC(=CC2=C1C(=O)C=C(O2)C)O
InChIKeyCRNGFKXWIYTEPH-UHFFFAOYSA-N
Subclass / scaffoldChromones
PubChem CID5316891

Computed properties

Exact mass (Da)190.063Predicted LogP2.1154
Predicted TPSA (Ų)50.44H-bond donors1
H-bond acceptors3Rotatable bonds0

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

View additional properties & classification
Ring count2
Aromatic rings2
Fraction Csp³0.182
Synthetic accessibility score2.36
QED score0.692
Lipinski rule violations0
NPClassifier pathwayPolyketides
NPClassifier superclassChromanes
NPClassifier classChromones
Parent SMILESCc1cc(=O)c2c(C)cc(O)cc2o1
Parent formulaC11H10O3
Parent molecular weight190.198
Specified stereocenters0
Unspecified stereocenters0

Reported natural occurrence

Main reported sourceAloe arborescens
Reported source familiesPleosporaceae; Asphodelaceae; Xylariaceae

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

View occurrence records & references
LOTUS / Wikidata speciesAloe arborescens[1]; Aloe ferox[1]; Annulohypoxylon truncatum[1]; Cassia fistula[1]; Curvularia lunata[1]; Papulaspora immersa[1]; Sonneratia alba[1]; Talaromyces flavus[1]
All reported source familiesPleosporaceae[2]; Asphodelaceae[2]; Xylariaceae[1]; Fabaceae[1]; Aspergillaceae[1]; Lythraceae[1]
Genus / family recordsAlternaria[3]; Penicillium[1]
LOTUS species records8
LOTUS reference records12
COCONUT occurrence recordsAconitum seravschanicum; Aconitum tasiromontanum; Adansonia grandidieri; Aloe arborescens; Aloe ferox; Alstonia muelleriana; Alternaria; Alternaria sp.; Alternaria species; Annulohypoxylon truncatum; Aphyllocladus denticulatus; Artemisia cina; Aster conspicuus; Aster sedifolius; Bassia muricata; Cape aloe; Cassia fistula; Caulocystis cephalornithos; Clitocybula oculus; Cochliobolus lunatus SCSIO41401; Coreopsis nodosa; Crotalaria ferruginea; Curvularia lunata; Cytophaga hutchinsoni; Dacrydium cupressinum; Dendriopoterium menendezii; Dictyopteris australis; Dodonaea viscosa; Dysoxylum cumingianum; Enceliopsis argophylla
COCONUT organism records81
COCONUT identifierCNP0190075.0

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.