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(4S,4aR,5S,5aR,6R,12aS)-4-(Dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydro-2-tetracenecarboxamide hydrochloride (1:1)(CAS: 10592-13-9)

(4S,4aR,5S,5aR,6R,12aS)-4-(Dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydro-2-tetracenecarboxamide hydrochloride (1:1)
CAS Number

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Basic Information

Molecular Formula
C22H25ClN2O8
Molecular Weight
480.9 g/mol

Physical Properties

Melting Point
219-225°C
Boiling Point
762.6°C at 760 mmHg
Density
1.63
Flash Point
87℃
Water Solubility
Soluble in water.

Chemical Identifiers

SMILES
CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.Cl
InChIKey
RUYHIJHUVHIMIR-CVHRZJFOSA-N

Database References

MDL Number
MFCD03427564

FAQ

This compound is a tetracene derivative with the molecular formula C21H25ClN2O7. It features multiple hydroxyl groups, a dimethylamino substituent, and a hydrochloride salt form, making it highly water-soluble. Its complex stereochemistry (4S,4aR,5S,5aR,6R,12aS) and structural elements, such as the 1,11-dioxo ring system, contribute to its chemical stability and reactivity in various applications.
This compound is primarily used in pharmaceutical research as an intermediate for drug development, particularly in targeting metabolic pathways. It also finds applications in organic synthesis and as a precursor for bioactive molecules. Its unique structure makes it relevant in studies related to enzyme inhibition and medicinal chemistry.
Safety of this compound depends on exposure conditions. It should be handled with appropriate protective equipment to avoid skin contact, inhalation, or eye exposure. While no specific toxicity data is provided, standard safety protocols for chemical handling apply. Always follow OSHA guidelines and consult safety data sheets for proper risk assessment.
Store this compound in a cool, dry place away from light, ideally at 2-8°C. Use airtight containers to prevent moisture absorption due to its hydrochloride salt form. Ensure it is kept in a chemically inert environment to maintain stability. Avoid exposure to humidity and direct sunlight to preserve its structural integrity and potency.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

Contact Information

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