Steroids

Glucodigitoxin

紫花洋地黄苷A

PHY-NP-10767 · Natural product research catalog

Catalog number	PHY-NP-10767
CAS number	19855-40-4
Molecular formula	C₄₇H₇₄O₁₈
Molecular weight	927.091 g/mol
Chemical class	Steroids
Main reported source	Digitalis purpurea
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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100 mg	Request quote	To be confirmed	Confirm in quotation

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Glucodigitoxin is listed in the Steroids 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]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)C[C@H](O)[C@@H]1O[C@H]1C[C@H](O)[C@H](O[C@H]2C[C@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C)O2)[C@@H](C)O1
InChIKey	BZJBLHNKKRCQEQ-ZFCLPHBQSA-N
Subclass / scaffold	Cardenolides；皂苷/苷

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

View additional properties & classification

Ring count	9
Aromatic rings	0
Fraction Csp³	0.936
Synthetic accessibility score	6.44
QED score	0.113
Lipinski rule violations	3
NPClassifier pathway	Terpenoids
NPClassifier superclass	Steroids
NPClassifier class	Cardenolides
Parent SMILES	C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@H]4[C@@H]3CC[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)C[C@H](O)[C@@H]1O[C@H]1C[C@H](O)[C@H](O[C@H]2C[C@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C)O2)[C@@H](C)O1
Parent formula	C₄₇H₇₄O₁₈
Parent molecular weight	927.091
Specified stereocenters	25
Unspecified stereocenters	0

Main reported source	Digitalis purpurea
Reported source families	Plantaginaceae

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

View occurrence records & references

LOTUS / Wikidata species	Digitalis purpurea[1]
All reported source families	Plantaginaceae[1]
LOTUS species records	1
LOTUS reference records	1
COCONUT occurrence records	Digitalis purpurea
COCONUT organism records	1
COCONUT identifier	CNP0163701.1

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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