Agnuside

For Research Use Only.
Category
Iridoids
Cat.No.
NP3886
CAS
11027-63-7
Product Name
Agnuside
Structure

Product Details

Description
Agnuside is isolated from the herbs of Vitex negundo L. It shows inhibition of vascular permeability and leukocyte migration in vivo.
Synonyms
[(1S,4aR,5S,7aS)-5-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl]methyl 4-hydroxybenzoate
IUPAC Name
[(1S,4aR,5S,7aS)-5-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl]methyl 4-hydroxybenzoate
Molecular Weight
466.44
Molecular Formula
C22H26O11
Canonical SMILES
C1=COC(C2C1C(C=C2COC(=O)C3=CC=C(C=C3)O)O)OC4C(C(C(C(O4)CO)O)O)O
InChI
InChI=1S/C22H26O11/c23-8-15-17(26)18(27)19(28)22(32-15)33-21-16-11(7-14(25)13(16)5-6-30-21)9-31-20(29)10-1-3-12(24)4-2-10/h1-7,13-19,21-28H,8-9H2/t13-,14+,15+,16+,17+,18-,19+,21-,22-/m0/s1
InChIKey
GLACGTLACKLUJX-QNAXTHAFSA-N
Boiling Point
785.5±60.0 °C | Condition: Press: 760 Torr
Melting Point
146 °C
Purity
97%
Density
1.59 g/cm3
Solubility
10 mM in DMSO
Appearance
Powder
Application
anti-arthritic activity
Shelf Life
2 month in rt, long time
Storage
-20°C Freezer
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