ChemicalBook--->CAS DataBase List--->40505-27-9

40505-27-9

40505-27-9 Structure

40505-27-9 Structure
IdentificationBack Directory
[Name]

4'-Demethylpodophyllotoxin
[CAS]

40505-27-9
[Synonyms]

4'-demethylpodophyllotoxin
4'-Demethylpodophyllotoxin USP/EP/BP
5-hydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-8-one
9-hydroxy-5-(4-hydroxy-3,5-dimethoxyphenyl)-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5ah)-one
(5R)-5,8,8aβ,9-Tetrahydro-9β-hydroxy-5β-(3,5-dimethoxy-4-hydroxyphenyl)furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aαH)-one
(5R)-5β-(4-Hydroxy-3,5-dimethoxyphenyl)-9β-hydroxy-5,5aα,6,8,8aβ,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d]-1,3-dioxole-6-one
(5R)-9β-Hydroxy-5,8,8aβ,9-tetrahydro-5β-(4-hydroxy-3,5-dimethoxyphenyl)furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxole-6(5aαH)-one
(5R)-5,8,8aβ,9-Tetrahydro-5β-(3,5-dimethoxy-4-hydroxyphenyl)-9β-hydroxyfuro[3',4':6,7]naphtho[2,3-d]-1,3-dioxole-6(5aαH)-one
(5R,5AR,8aR,9R)-9-hydroxy-5-(4-hydroxy-3,5-dimethoxyphenyl)-5,5a,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(8H)-one
Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 5,8,8a,9-tetrahydro-9-hydroxy-5-(4-hydroxy-3,5-dimethoxyphenyl)-, (5R,5aR,8aR,9R)-
[Molecular Formula]

C21H20O8
[MOL File]

40505-27-9.mol
[Molecular Weight]

400.38
Chemical PropertiesBack Directory
[Melting point ]

250-252 °C
[Boiling point ]

626.5±55.0 °C(Predicted)
[density ]

1.446±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

DMSO : 250 mg/mL (624.41 mM; Need ultrasonic)
[form ]

Cryst.
[pka]

9.94±0.40(Predicted)
[color ]

White to off-white
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Hazard InformationBack Directory
[Chemical Properties]

White powder, soluble in organic solvents such as methanol, ethanol, and DMSO. It is derived from the rhizomes of Sinopodophyllum hexandrum (Royle) Ying and Dysosma versipellis (Hance) M. Cheng ex Ying.
[Uses]

4’-Demethylpodophyllotoxin is a lignan studied for its content in different parts of Sinopodophyllum hexandrum.
[Definition]

ChEBI: An organic heterotetracyclic compound that is podophyllotoxin in which the methyl ether group at position 4 of the trimethoxyphenyl group has been cleaved to afford the corresponding phenol.
Spectrum DetailBack Directory
[Spectrum Detail]

4'-Demethylpodophyllotoxin(40505-27-9)1HNMR
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