ChemicalBook--->CAS DataBase List--->99353-00-1

99353-00-1

99353-00-1 Structure

99353-00-1 Structure
IdentificationBack Directory
[Name]

Methyl rosmarinate
[CAS]

99353-00-1
[Synonyms]

Methyl rosmarinate
rosmarinic acid methyl ester
(R)-3-(3,4-Dihydroxyphenyl)-1-methoxy-1-oxopropan-2-yl (E)-3-(3,4-dihydroxyphenyl)acrylate
Benzenepropanoic acid, α-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-3,4-dihydroxy-, methyl ester, (αR)-
[Molecular Formula]

C19H18O8
[MDL Number]

MFCD20260544
[MOL File]

99353-00-1.mol
[Molecular Weight]

374.35
Chemical PropertiesBack Directory
[Boiling point ]

655.4±55.0 °C(Predicted)
[density ]

1.449±0.06 g/cm3(Predicted)
[storage temp. ]

4°C, protect from light
[solubility ]

Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
[form ]

Powder
[pka]

9.29±0.10(Predicted)
[color ]

White to off-white
[InChI]

InChI=1/C19H18O8/c1-26-19(25)17(10-12-3-6-14(21)16(23)9-12)27-18(24)7-4-11-2-5-13(20)15(22)8-11/h2-9,17,20-23H,10H2,1H3/b7-4+/t17-/s3
[InChIKey]

XHALVRQBZGZHFE-NSRMBFSVNA-N
[SMILES]

C(C1C=CC(O)=C(O)C=1)[C@H](C(=O)OC)OC(=O)/C=C/C1C=CC(O)=C(O)C=1 |&1:9,r|
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
[Uses]

Methyl Rosmarinate is a novel S6K1 inhibitor, used as a therapeutic agent against cervical cancer.Methyl Rosmarinate is a noncompetitive tyrosinase inhibitor which is isolated from Rabdosia serra. An inhibitor of a-glucosidase
[Definition]

ChEBI: Methyl rosmarinate is a hydroxycinnamic acid.
Spectrum DetailBack Directory
[Spectrum Detail]

Methyl rosmarinate(99353-00-1)1HNMR
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