Xanthones

Decussatin

1-羟基-3,7,8-三甲氧基口山酮

PHY-NP-05106 · Natural product research catalog

Catalog number	PHY-NP-05106
CAS number	20882-69-3
Molecular formula	C₁₆H₁₄O₆
Molecular weight	302.282 g/mol
Chemical class	Xanthones
Main reported source	Centaurium erythraea
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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5 mg	Request quote	To be confirmed	Confirm in quotation
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20 mg	Request quote	To be confirmed	Confirm in quotation
50 mg	Request quote	To be confirmed	Confirm in quotation
100 mg	Request quote	To be confirmed	Confirm in quotation

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Decussatin is listed in the Xanthones 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	8-hydroxy-1,2,6-trimethoxyxanthen-9-one
SMILES	COC1=C(C2=C(C=C1)OC3=CC(=CC(=C3C2=O)O)OC)OC
InChIKey	VYRIGRQQKUZPEX-UHFFFAOYSA-N
Subclass / scaffold	Methyl xanthones Plant xanthones
PubChem CID	5378284

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

View additional properties & classification

Ring count	3
Aromatic rings	3
Fraction Csp³	0.188
Synthetic accessibility score	2.3
QED score	0.749
Lipinski rule violations	0
NPClassifier pathway	Polyketides
NPClassifier superclass	Xanthones
NPClassifier class	Methyl xanthones；Plant xanthones
Parent SMILES	COc1cc(O)c2c(=O)c3c(OC)c(OC)ccc3oc2c1
Parent formula	C₁₆H₁₄O₆
Parent molecular weight	302.282
Specified stereocenters	0
Unspecified stereocenters	0

Main reported source	Centaurium erythraea
Reported source families	Gentianaceae; Cannabaceae

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

View occurrence records & references

LOTUS / Wikidata species	Centaurium erythraea[4]; Centaurium pulchellum[4]; Gentianopsis paludosa[3]; Anthocleista vogelii[2]; Gentiana acaulis[2]; Gentiana orbicularis[2]; Swertia calycina[2]; Canscora alata[1]; Centaurium cachanlahuen[1]; Chironia krebsii[1]; Eustoma grandiflorum[1]; Eustoma russellianum[1]; Gentiana bavarica[1]; Gentiana brachyphylla[1]; Gentiana lutea[1]
All reported source families	Gentianaceae[49]; Cannabaceae[1]
LOTUS species records	50
LOTUS reference records	35
COCONUT occurrence records	Andrographis paniculata; Anthocleista vogelii; Anthocleista vogelli; Canscora Decussata; Canscora alata; Canscora decussata; Centaurea cachanahuen; Centaurium cachanlahuen; Centaurium erythraea; Centaurium linarifolium; Centaurium linariifolium; Centaurium pulchellum; Chironia krebsii; Comastoma pulmonarium; Eustoma grandiflorum; Eustoma russellianum; Gentiana acaulis; Gentiana barbata; Gentiana bavarica; Gentiana brachyphylla; Gentiana campestris; Gentiana ciliata; Gentiana detonsa; Gentiana favrati; Gentiana favratii; Gentiana kochiana; Gentiana nivalis; Gentiana orbicularis; Gentiana ramosa; Gentiana rostanii
COCONUT organism records	78
COCONUT identifier	CNP0294547.0

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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