CAS 54747-66-9

Furo[3′,4′:6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 5,8,8a,9-tetrahydro-9-hydroxy-5-(3-hydroxy-4,5-dimethoxyphenyl)-, [5R-(5α,5aβ,8aα,9α)]-

Description:

Furo[3′,4′:6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, with the CAS number 54747-66-9, is a complex organic compound characterized by its unique fused ring structure that incorporates both furan and naphthalene moieties. This compound features a dioxolane ring, which contributes to its stability and reactivity. The presence of multiple hydroxyl groups and methoxy substituents indicates potential for hydrogen bonding and increased solubility in polar solvents. Its stereochemistry, denoted by the specific R and S configurations, suggests that it may exhibit chiral properties, which can influence its biological activity and interactions with other molecules. Such compounds often possess interesting pharmacological properties, making them subjects of research in medicinal chemistry. The intricate arrangement of functional groups may also allow for various synthetic modifications, enhancing its utility in chemical synthesis and drug development. Overall, this compound exemplifies the complexity and diversity found in organic chemistry, particularly in the realm of natural product derivatives.

Formula: C₂₁H₂₀O₈

InChI: InChI=1/C21H20O8/c1-25-16-4-9(3-13(22)20(16)26-2)17-10-5-14-15(29-8-28-14)6-11(10)19(23)12-7-27-21(24)18(12)17/h3-6,12,17-19,22-23H,7-8H2,1-2H3

InChI key: InChIKey=KKHOARWEVJJBTK-BTINSWFASA-N

SMILES: O=C1[C@@]2([C@@H](C=3C([C@H](O)[C@]2(CO1)[H])=CC4=C(C3)OCO4)C5=CC(OC)=C(OC)C(O)=C5)[H]

Synonyms:

• NSC 251681
• 3′-Demethylpodophyllotoxin
• Furo[3′,4′:6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 5,8,8a,9-tetrahydro-9-hydroxy-5-(3-hydroxy-4,5-dimethoxyphenyl)-, [5R-(5α,5aβ,8aα,9α)]-

(5R,5aR,8aR,9R)-9-Hydroxy-5-(3-hydroxy-4,5-dimethoxyphenyl)-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one

CAS: 54747-66-9

Formula: C₂₁H₂₀O₈

Molecular weight: 400.38

Ref: ST-EA-CP-E31034