CAS 19275-46-8|5,9-Dihydroxy-8-methoxy-2,2-dimethyl-7-(3-methyl-2-buten-1-yl)-3,4-dihydro-2H,6H-pyra

Introduction：Basic information about CAS 19275-46-8|5,9-Dihydroxy-8-methoxy-2,2-dimethyl-7-(3-methyl-2-buten-1-yl)-3,4-dihydro-2H,6H-pyra, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name5,9-Dihydroxy-8-methoxy-2,2-dimethyl-7-(3-methyl-2-buten-1-yl)-3,4-dihydro-2H,6H-pyrano[3,2-b]xanthen-6-one
CAS Number19275-46-8Molecular Weight410.460
Density1.3±0.1 g/cm3Boiling Point615.9±55.0 °C at 760 mmHg
Molecular FormulaC24H26O6Melting Point155-160ºC
MSDS/Flash Point212.3±25.0 °C

Names

Name3-isomangostin
SynonymMore Synonyms

BiologicalActivity

Description3-Isomangostin, extracted from Garciniamangostana.L. shell, is a potent MutT homologue 1 (MTH1) inhibitor with an IC50 value of 52 nM. 3-isomangostin would be an attractive chemical tool for the development of anticancer agents[1].
Related CatalogResearch Areas >>CancerSignaling Pathways >>Others >>Others
References

[1]. Yokoyama T, et al. Discovery of a new class of MTH1 inhibitor by X-ray crystallographic screening. Eur J Med Chem. 2019 Apr 1;167:153-160.

Chemical & Physical Properties

Density1.3±0.1 g/cm3
Boiling Point615.9±55.0 °C at 760 mmHg
Melting Point155-160ºC
Molecular FormulaC24H26O6
Molecular Weight410.460
Flash Point212.3±25.0 °C
Exact Mass410.172943
PSA89.13000
LogP5.72
Vapour Pressure0.0±1.8 mmHg at 25°C
Index of Refraction1.605
InChIKeyKJCDBAVVDILRMP-UHFFFAOYSA-N
SMILESCOc1c(O)cc2oc3cc4c(c(O)c3c(=O)c2c1CC=C(C)C)CCC(C)(C)O4

Synonyms

5,9-Dihydroxy-8-methoxy-2,2-dimethyl-7-(3-methyl-2-buten-1-yl)-3,4-dihydro-2H,6H-pyrano[3,2-b]xanthen-6-one
5,9-dihydroxy-8-methoxy-2,2-dimethyl-7-(3-methyl-but-2-enyl)-3,4-dihydro-2H-pyrano[3,2-b]xanthen-6-one
2H,6H-Pyrano[3,2-b]xanthen-6-one, 3,4-dihydro-5,9-dihydroxy-8-methoxy-2,2-dimethyl-7-(3-methyl-2-buten-1-yl)-
9-hydroxycalabaxanthone
3,4-Dihydro-5,9-dihydroxy-8-methoxy-2,2-dimethyl-7-(3-methyl-2-butenyl)-2H,6H-pyrano[3,2-b]xanthen-6-one
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CAS 900015-32-9|3-methyl-1-[5-(2,2,2-trichloroacetyl)-1H-pyrrol-3-yl]-1-butanone
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