(16R)-17-(Acetoxy)-2α,5α-epoxy-1,2-dihydroakuammilan-16-carboxylic acid methyl ester

For Research Use Only.
Category
Alkaloids
Cat.No.
NP0482
CAS
2671-32-1
Product Name
(16R)-17-(Acetoxy)-2α,5α-epoxy-1,2-dihydroakuammilan-16-carboxylic acid methyl ester
Structure

Product Details

Description
Picraline is a natural alkaloid found in the herbs of Rauvolfia verticillata. Picraline shows potent SGLT inhibitory activity.
Synonyms
(16R)-17-(Acetoxy)-2α,5α-epoxy-1,2-dihydroakuammilan-16-carboxylic acid methyl ester
IUPAC Name
methyl 19-(acetyloxymethyl)-14-ethylidene-18-oxa-2,12-diazahexacyclo[9.6.1.19,15.01,9.03,8.012,17]nonadeca-3,5,7-triene-19-carboxylate
Molecular Weight
410.5
Molecular Formula
C23H26N2O5
Canonical SMILES
CC=C1CN2C3CC1C(C45C3(NC6=CC=CC=C64)OC2C5)(COC(=O)C)C(=O)OC
InChI
InChI=1S/C23H26N2O5/c1-4-14-11-25-18-9-16(14)21(20(27)28-3,12-29-13(2)26)22-10-19(25)30-23(18,22)24-17-8-6-5-7-15(17)22/h4-8,16,18-19,24H,9-12H2,1-3H3
InChIKey
DXTJMQCRVFWNBD-UHFFFAOYSA-N
Boiling Point
548.0±50.0°C (Predicted)
Melting Point
160-162°C
Purity
>96%
Density
1.38±0.1 g/cm3(Predicted)
Appearance
Powder
Color
Orange
Form
Powder
MDL
MFCD26406067
Packaging
1 mg
pKa
3.89±0.40(Predicted)
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