(-)-Maackiain Chemical Properties

Melting point:

179～181℃

Boiling point:

436.2±45.0 °C(Predicted)

Density 

1.480±0.06 g/cm3(Predicted)

storage temp. 

4°C, protect from light

solubility 

Soluble in ethanol and methanol;

pka

9.45±0.20(Predicted)

form 

powder

color 

White

Water Solubility 

sparingly soluble in water

Major Application

food and beverages

InChI

1S/C16H12O5/c17-8-1-2-9-12(3-8)18-6-11-10-4-14-15(20-7-19-14)5-13(10)21-16(9)11/h1-5,11,16-17H,6-7H2/t11-,16-/m0/s1

InChIKey

HUKSJTUUSUGIDC-ZBEGNZNMSA-N

SMILES

O1[C@@H]2[C@@H](COc5c2ccc(c5)O)c3c1cc4c(c3)OCO4

Safety Information

WGK Germany 

WGK 3

Storage Class

11 - Combustible Solids

(-)-Maackiain Usage And Synthesis

Uses

(-)-Maackiain (CAS# 2035-15-6) has potential use in mechanisms of Pyrrosiae Folium in treating prostate cancer based on network pharmacology and molecular docking.

Definition

ChEBI: (-)-maackiain is the (-)-enantiomer of maackiain. It is an enantiomer of a (+)-maackiain.

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