Cleomiscosin A

For Research Use Only.
Category
Lignans
Cat.No.
NP3923
CAS
76948-72-6
Product Name
Cleomiscosin A
Structure

Product Details

Description
Cleomiscosin A is isolated from the herbs of Buxus sinica.
Synonyms
(2R,3R)-rel-2,3-Dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-5-methoxy-9H-pyrano[2,3-f]-1,4-benzodioxin-9-one
IUPAC Name
(2R,3R)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-5-methoxy-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-9-one
Molecular Weight
386.36
Molecular Formula
C20H18O8
Canonical SMILES
COC1=C(C=CC(=C1)C2C(OC3=C4C(=CC(=C3O2)OC)C=CC(=O)O4)CO)O
InChI
InChI=1S/C20H18O8/c1-24-13-7-10(3-5-12(13)22)17-15(9-21)26-20-18-11(4-6-16(23)27-18)8-14(25-2)19(20)28-17/h3-8,15,17,21-22H,9H2,1-2H3/t15-,17-/m1/s1
InChIKey
OCBGWPJNUZMLCA-NVXWUHKLSA-N
Boiling Point
632.7±55.0 °C(Predicted)
Melting Point
245-247 °C
Purity
97%
Density
1.403g/cm3
Solubility
Acetonitrile (Slightly, Heated), methanol (Slightly), Pyridine (Slightly)
Appearance
Powder
Application
anti-inflammatory activity
Storage
-20°C Freezer, Under inert atmosphere
Color
White to Off-White
Definition
ChEBI: An organic heterotricyclic compound that is 2,3-dihydro-9H-[1,4]dioxino[2,3-h]chromen-9-one substituted by 4-hydroxy-3-methoxy phenyl group at position 3, a hydroxymethyl group at position 2 and a methoxy group at position 5 (the 2R,3R stereoisomer). It exhibits anti-inflammatory activity.
Form
Solid
pKa
9.65±0.35(Predicted)
Uses
Cleomiscosin A is a known coumarinolignan and an important constituent of the methanolic extract of Hyoscyamus niger seeds (MHN) responsible for anti-inflammatory activity.
  • Verification code
Online Inquiry
  • Verification code
×
Top
Inquiry Basket