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Chemical structure of Steviolmonoside
Diterpenoids

Steviolmonoside

甜菊醇-13-葡萄糖苷

PHY-NP-02826 · Natural product research catalog

Catalog numberPHY-NP-02826
CAS number60129-60-4
Molecular formulaC26H40O8
Molecular weight480.598 g/mol
Chemical classDiterpenoids
Purity / assayConfirmed in quotation and batch COA

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Product information

Steviolmonoside is listed in the Diterpenoids 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 name(1R,4S,5R,9S,10R,13S)-5,9-dimethyl-14-methylidene-13-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
SMILESC[C@@]12CCC[C@@]([C@H]1CC[C@]34[C@H]2CC[C@](C3)(C(=C)C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)(C)C(=O)O
InChIKeyQSIDJGUAAUSPMG-CULFPKEHSA-N
Subclass / scaffoldKaurane and Phyllocladane diterpenoids Tetracyclic diterpenoids
PubChem CID21593622

Computed properties & structure classification

Exact mass (Da)480.2723Predicted LogP1.9792
Predicted TPSA (Ų)136.68H-bond donors5
H-bond acceptors7Rotatable bonds4
Ring count5Aromatic rings0
Fraction Csp³0.885Synthetic accessibility score6.17
QED score0.304Lipinski rule violations0
NPClassifier pathwayTerpenoidsNPClassifier superclassDiterpenoids
NPClassifier classKaurane and Phyllocladane diterpenoids;Tetracyclic diterpenoidsParent SMILESC=C1C[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C(=O)O)[C@@H]2CC[C@]1(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C3
Parent formulaC26H40O8Parent molecular weight480.598
Specified stereocenters11Unspecified stereocenters0

Structure-derived values from the supplied dataset; not measured batch specifications or experimentally verified activity.

Reported natural occurrence

Main reported sourceRubus chingii var. suavissimus
LOTUS / Wikidata speciesRubus chingii var. suavissimus(甜叶悬钩子)[1]
Source familiesRosaceae[1]
LOTUS species records1
LOTUS reference records1
COCONUT occurrence recordsRubus chingii var. suavissimus;Stevia Rebaudiana;Stevia rebaudiana
COCONUT organism records3
COCONUT identifierCNP0204668.1

Occurrence records are inherited from the supplied dataset. They do not establish manufacturing origin, batch traceability or independent literature verification. Taxonomic names may include synonyms.

Structure resources

Documents & specifications

Certificate of analysis (COA)Batch-specific document pending; not available in this preview
Safety data sheet (SDS)Not yet published
Storage / solubilityProduct-specific conditions to be confirmed
ShippingConfirmed with the quotation

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