Diterpenoids

Dugesin C

宾鼠尾草素C

PHY-NP-02571 · Natural product research catalog

Catalog number	PHY-NP-02571
CAS number	1403505-97-4
Molecular formula	C₂₀H₁₈O₅
Molecular weight	338.359 g/mol
Chemical class	Diterpenoids
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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Dugesin C 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.

IUPAC name	(3'S,3aS,4R)-3'-(furan-3-yl)-4'-methylidenespiro[3,3a,5,6-tetrahydro-2-benzofuran-4,5'-6,7-dihydro-3H-2-benzofuran]-1,1'-dione
SMILES	C=C1C2=C(CC[C@@]13CCC=C4[C@H]3COC4=O)C(=O)O[C@@H]2C5=COC=C5
InChIKey	ZXFKNAXSKBAYQY-MDYRTPRTSA-N
Subclass / scaffold	Colensane and Clerodane diterpenoids
PubChem CID	168265987

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

View additional properties & classification

Ring count	5
Aromatic rings	1
Fraction Csp³	0.4
Synthetic accessibility score	5.2
QED score	0.734
Lipinski rule violations	0
NPClassifier pathway	Terpenoids
NPClassifier superclass	Diterpenoids
NPClassifier class	Colensane and Clerodane diterpenoids
Parent SMILES	C=C1C2=C(CC[C@@]13CCC=C1C(=O)OC[C@H]13)C(=O)O[C@@H]2c1ccoc1
Parent formula	C₂₀H₁₈O₅
Parent molecular weight	338.359
Specified stereocenters	3
Unspecified stereocenters	0

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

View occurrence records & references

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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