Isotaxiresinol

For Research Use Only.
Category
Lignans
Cat.No.
NP3924
CAS
26194-57-0
Product Name
Isotaxiresinol
Structure

Product Details

Description
Isotaxiresinol is a natural lignan found in the branch of Taxus wallichiana. Isotaxiresinol is useful for the treatment of postmenopausal osteoporosis, especially for prevention of bone fracture induced by estrogen deficiency.
Synonyms
Methyl 3-bromo-2-thiophenecarboxylate
IUPAC Name
4-[(1S,2R,3R)-7-hydroxy-2,3-bis(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]benzene-1,2-diol
Molecular Weight
346.38
Molecular Formula
C19H22O6
Canonical SMILES
COC1=C(C=C2C(C(C(CC2=C1)CO)CO)C3=CC(=C(C=C3)O)O)O
InChI
InChI=1S/C19H22O6/c1-25-18-6-11-4-12(8-20)14(9-21)19(13(11)7-17(18)24)10-2-3-15(22)16(23)5-10/h2-3,5-7,12,14,19-24H,4,8-9H2,1H3/t12-,14-,19-/m0/s1
InChIKey
GQLVRVYXAHDDLB-PJFSTRORSA-N
Boiling Point
607.6±55.0 °C(Predicted)
Melting Point
171 °C
Purity
>95%
Density
1.348±0.06 g/cm3(Predicted)
Appearance
Powder
Application
anti-cancer; anti-osteoporosis
pKa
9.72±0.10(Predicted)
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