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Alkaloids

(+-)-Sinactine

四氢表小檗碱

PHY-NP-10303 · Natural product research catalog

Catalog numberPHY-NP-10303
CAS number38853-67-7
Molecular formulaC20H21NO4
Molecular weight339.391 g/mol
Chemical classAlkaloids
Main reported sourcePapaver rhoeas
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of (+-)-Sinactine

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Product information

(+-)-Sinactine is listed in the Alkaloids 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 name16,17-dimethoxy-5,7-dioxa-1-azapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),9,14,16,18-hexaene
SMILESCOC1=C(C=C2C3CC4=C(CN3CCC2=C1)C5=C(C=C4)OCO5)OC
InChIKeyUWEHVAXMSWXKRW-UHFFFAOYSA-N
Subclass / scaffoldTyrosine alkaloids:Isoquinoline alkaloids Protoberberine alkaloids
PubChem CID5321317

Computed properties

Exact mass (Da)339.1471Predicted LogP3.088
Predicted TPSA (Ų)40.16H-bond donors0
H-bond acceptors5Rotatable bonds2

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

View additional properties & classification
Ring count5
Aromatic rings2
Fraction Csp³0.4
Synthetic accessibility score3.0
QED score0.841
Lipinski rule violations0
NPClassifier pathwayAlkaloids
NPClassifier superclassTyrosine alkaloids
NPClassifier classIsoquinoline alkaloids;Protoberberine alkaloids
Parent SMILESCOc1cc2c(cc1OC)C1Cc3ccc4c(c3CN1CC2)OCO4
Parent formulaC20H21NO4
Parent molecular weight339.391
Specified stereocenters0
Unspecified stereocenters1

Reported natural occurrence

Main reported sourcePapaver rhoeas
Reported source familiesPapaveraceae; Menispermaceae; Annonaceae

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

View occurrence records & references
LOTUS / Wikidata speciesPapaver rhoeas[4]; Fumaria densiflora[3]; Fumaria muralis[2]; Fumaria parviflora[2]; Fumaria rostellata[2]; Papaver commutatum[2]; Papaver confine[2]; Cocculus pendulus[1]; Corydalis meifolia[1]; Corydalis nobilis[1]; Corydalis remota[1]; Corydalis rutifolia[1]; Corydalis solida[1]; Corydalis thyrsiflora[1]; Corydalis uniflora[1]
All reported source familiesPapaveraceae[21]; Menispermaceae[1]; Annonaceae[1]
Genus / family recordsPapaveraceae[1]
LOTUS species records23
LOTUS reference records17
COCONUT occurrence recordsCocculus laurifolius; Cocculus laurifolius DC.; Cocculus pendulus (Forsk.) Diels; Corydalis marschalliana Pers.; Corydalis nobilis; Corydalis solida; Corydalis thyrsifolia; Eschscholzia californica; Fumaria agraria; Fumaria capreolata; Fumaria densiflora; Fumaria muralis; Fumaria officinalis; Fumaria parviflora; Fumaria schleicheri Soy.-Will.; Fumaria vaillantii; Glaucium flavum; Glaucium flavum Crantz.; Papaver armeniacum; Papaver commutatum; Papaver confine; Papaver tauricola; Papaver trinifolium; Papaver triniifolium; Sinomenium acutum Rehd.et Wils
COCONUT organism records25
COCONUT identifierCNP0301756.2

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.