Flavonoids

Tamarixetin-3-O-rutinoside

柽柳黄素-3-芸香糖苷

PHY-NP-18032 · Natural product research catalog

Catalog number	PHY-NP-18032
CAS number	20550-05-4
Molecular formula	C₂₈H₃₂O₁₆
Molecular weight	624.548 g/mol
Chemical class	Flavonoids
Main reported source	Calendula officinalis
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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Tamarixetin-3-O-rutinoside 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.

SMILES	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)OC)O)O)O)O)O)O)O
InChIKey	KEIZXGINFPDITQ-GEBJFKNCSA-N
Subclass / scaffold	Flavonols
PubChem CID	5320020

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

View additional properties & classification

Ring count	5
Aromatic rings	3
Fraction Csp³	0.464
Synthetic accessibility score	4.76
QED score	0.147
Lipinski rule violations	3
NPClassifier pathway	Shikimates and Phenylpropanoids
NPClassifier superclass	Flavonoids
NPClassifier class	Flavonols
Parent SMILES	COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc1O
Parent formula	C₂₈H₃₂O₁₆
Parent molecular weight	624.548
Specified stereocenters	10
Unspecified stereocenters	0

Main reported source	Calendula officinalis
Reported source families	Fabaceae; Asteraceae; Rutaceae

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

View occurrence records & references

LOTUS / Wikidata species	Calendula officinalis[3]; Aerva lanata[2]; Coleogyne ramosissima[2]; Anvillea garcinii[1]; Aster koraiensis[1]; Astragalus aegobromus[1]; Astragalus dasyanthus[1]; Astragalus levieri[1]; Astragalus sevangensis[1]; Astragalus varius[1]; Berchemia floribunda[1]; Berchemia racemosa[1]; Bupleurum longeradiatum[1]; Caragana aurantiaca[1]; Caragana pygmaea[1]
All reported source families	Fabaceae[12]; Asteraceae[5]; Rutaceae[3]; Rosaceae[2]; Rhamnaceae[2]; Apiaceae[2]
LOTUS species records	38
LOTUS reference records	38
COCONUT occurrence records	Aerva lanata; Anvillea garcinii; Aster koraiensis; Astragalus aegobromus; Astragalus dasyanthus; Astragalus levieri; Astragalus sevangensis; Astragalus varius; Berchemia floribunda; Berchemia racemosa; Bupleurum longeradiatum; Calendula officinalis; Caragana aurantiaca; Caragana pygmaea; Caragana spinosa; Cephalotaxus harringtonii var. harringtonii; Citrus reticulata; Citrus unshiu; Citrus × deliciosa; Coleogyne ramosissima; Daniellia oliveri; Dysphania procera; Glycyrrhiza echinata; Glycyrrhiza uralensis; Hypericum ascyron; Kandelia candel; Laennecia filaginoides; Lathyrus aphaca; Lentinus tigrinus; Litchi chinensis
COCONUT organism records	41
COCONUT identifier	CNP0184447.1

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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