CAS 31858-66-9|Mycophenolic Acid Methyl Ester

Introduction:Basic information about CAS 31858-66-9|Mycophenolic Acid Methyl Ester, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameMycophenolic Acid Methyl Ester
CAS Number31858-66-9Molecular Weight334.36400
Density1.222g/cm3Boiling Point540.4ºC at 760 mmHg
Molecular FormulaC18H22O6Melting Point105-106ºC
MSDS/Flash Point194.1ºC

Names

Namemethyl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
SynonymMore Synonyms

Mycophenolic Acid Methyl Ester BiologicalActivity

DescriptionMethyl mycophenolate is a methyl ester of mycophenolic acid and is also found in marine-derived fungus Phaeosphaeria spartinae[1][2].
Related CatalogResearch Areas >>OthersSignaling Pathways >>Others >>Others
References

[1]. Elsebai MF. Secondary metabolites from the marine-derived fungus Phaeosphaeria spartinae. Nat Prod Res. 2019 Aug 23:1-6.

[2]. Gainer FE, et al. Thin-layer chromatography of mycophenolic acid and related compounds. J Chromatogr. 1971 Feb 3;54(3):446-8.

Chemical & Physical Properties

Density1.222g/cm3
Boiling Point540.4ºC at 760 mmHg
Melting Point105-106ºC
Molecular FormulaC18H22O6
Molecular Weight334.36400
Flash Point194.1ºC
Exact Mass334.14200
PSA82.06000
LogP2.82160
Index of Refraction1.556
InChIKeyZPXRQFLATDNYSS-BJMVGYQFSA-N
SMILESCOC(=O)CCC(C)=CCc1c(O)c2c(c(C)c1OC)COC2=O

Synonyms

UNII-0B5C0EG8E8
Mycophenolic Acid Methyl Ester
mucophenolic acid
methyl mycophenolate
MPA-OMe
Mycophenolate Mofetil Impurity 5
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