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(9R,9'R)-5-(beta-D-Glucopyranosyloxy)-5'-(D-glucopyranosyloxy)-4,4'-dihydroxy-10,10'-dioxo-9,9',10,10'-tetrahydro-9,9'-bianthracene-2,2'-dicarboxylic acid(CAS: 81-27-6)

(9R,9'R)-5-(beta-D-Glucopyranosyloxy)-5'-(D-glucopyranosyloxy)-4,4'-dihydroxy-10,10'-dioxo-9,9',10,10'-tetrahydro-9,9'-bianthracene-2,2'-dicarboxylic acid
CAS Number

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Basic Information

Molecular Formula
C42H38O20
Molecular Weight
862.75 g/mol
Physical State
Brown powder

Physical Properties

Melting Point
200oC-240oC
Boiling Point
1144.8°C at 760 mmHg
Density
1.7430
Flash Point
348.6°C

Chemical Identifiers

SMILES
c1cc2c(c(c1)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)c4c(cc(cc4O)C(=O)O)[C@@H]2[C@@H]5c6cccc(c6C(=O)c7c5cc(cc7O)C(=O)O)OC8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O
InChIKey
IPQVTOJGNYVQEO-GTCVFCFLSA-N

Database References

MDL Number
MFCD00151527

FAQ

This compound is a complex glycoside derivative of bianthracene, featuring beta-D-glucopyranosyloxy groups at the 5 and 5' positions, along with hydroxyl and dioxo functionalities. Its molecular structure includes two anthracene rings connected via a bridging oxygen, with glucose moieties attached, making it a specialized organic molecule used in advanced chemical research. The CAS number 81-27-6 confirms its unique identification in chemical databases.
This compound is primarily used in pharmaceutical research for studying biological activity and as a precursor in synthetic chemistry. Its unique structure may also find applications in drug development and functional material design. The CAS number 81-27-6 is relevant for identifying its use in specialized chemical applications and scientific studies.
Safety data for this compound is limited, but general handling precautions apply. It should be used in well-ventilated areas with appropriate protective equipment. The CAS number 81-27-6 is used to reference its safety profile in chemical regulations, and while no specific toxicity is widely documented, standard lab safety practices are recommended for its use.
Store this compound in a cool, dry, and dark environment to maintain stability. Keep it in a sealed container to prevent moisture ingress and ensure it is protected from light exposure. The CAS number 81-27-6 is critical for tracking storage requirements, and it should be kept away from incompatible substances to preserve its chemical integrity.

Safety Notice

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

Always follow proper handling procedures