Apocarotenoids

6,9,10-Trihydroxy-7-megastigmen-3-one

6,9,10-三羟基-7-巨豆烯-3-酮

PHY-NP-16278 · Natural product research catalog

Catalog number	PHY-NP-16278
CAS number	476682-97-0
Molecular formula	C₁₃H₂₂O₄
Molecular weight	242.315 g/mol
Chemical class	Apocarotenoids
Main reported source	Aspergillus terreus
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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Pack	Price (USD)	Availability	Lead time
5 mg	Request quote	To be confirmed	Confirm in quotation
10 mg	Request quote	To be confirmed	Confirm in quotation
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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Product information

6,9,10-Trihydroxy-7-megastigmen-3-one is listed in the Apocarotenoids 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

SMILES	C[C@@H]1CC(=O)CC([C@]1(/C=C/C(CO)O)O)(C)C
InChIKey	NPIIJTPCHBVBJO-GKKQKQIKSA-N
Subclass / scaffold	Apocarotenoids (β-)
PubChem CID	91885191

Computed properties

Exact mass (Da)	242.1518	Predicted LogP	0.6521
Predicted TPSA (Å²)	77.76	H-bond donors	3
H-bond acceptors	4	Rotatable bonds	3

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

View additional properties & classification

Ring count	1
Aromatic rings	0
Fraction Csp³	0.769
Synthetic accessibility score	4.47
QED score	0.635
Lipinski rule violations	0
NPClassifier pathway	Terpenoids
NPClassifier superclass	Apocarotenoids
NPClassifier class	Apocarotenoids (β-)
Parent SMILES	C[C@@H]1CC(=O)CC(C)(C)[C@@]1(O)/C=C/C(O)CO
Parent formula	C₁₃H₂₂O₄
Parent molecular weight	242.315
Specified stereocenters	2
Unspecified stereocenters	1

Reported natural occurrence

Main reported source	Aspergillus terreus

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

View occurrence records & references

LOTUS species records	0
LOTUS reference records	0
COCONUT occurrence records	Aspergillus terreus
COCONUT organism records	1
COCONUT identifier	CNP0563190.3

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 / solubility	Product-specific conditions to be confirmed
Shipping	Confirmed with the quotation

Request applicable documentation and handling information before ordering or use.