INDACONITINE

Inquiry
For Research Use Only.
Category
Alkaloids
Cat.No.
NP0087
CAS
4491-19-4
Product Name
INDACONITINE
Structure
Structure
Size Price Stock Quantity
5 mg $299 In stock

Product Details

Description
Extract from Aconitum carmichaeli Debx.
Synonyms
(3alpha,6alpha,14alpha,16beta)-8-(acetyloxy)-20-ethyl-3,13-dihydroxy-1,6,16-trimethoxy-4-(methoxymethyl)aconitan-14-yl benzoate
IUPAC Name
[(1S,2R,3R,4R,5S,6S,8R,9R,13R,14R,16S,17S,18R)-8-acetyloxy-11-ethyl-5,14-dihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
Molecular Weight
629.74
Molecular Formula
C34H47NO10
Canonical SMILES
CCN1CC2(C(CC(C34C2C(C(C31)C5(CC(C6(CC4C5C6OC(=O)C7=CC=CC=C7)O)OC)OC(=O)C)OC)OC)O)COC
InChI
1S/C34H47NO10/c1-7-35-16-31(17-40-3)21(37)13-22(41-4)34-20-14-32(39)23(42-5)15-33(45-18(2)36,25(28(34)35)26(43-6)27(31)34)24(20)29(32)44-30(38)19-11-9-8-10-12-19/h8-12,20-29,37,39H,7,13-17H2,1-6H3/t20-,21-,22+,23+,24-,25+,26+,27-,28?,29-,31+,32+,33-,34+/m
InChIKey
PHDZNMWTZQPAEW-ZIVNFORMSA-N
Boiling Point
666.59°C (rough estimate)
Melting Point
193-195°C
Purity
>98%
Density
1.33 g/cm3
Solubility
Soluble in DMSO
Appearance
Powder
Application
A Alkaloids
Shelf Life
As supplied, 2 years from the QC date provided on the Certificate of Analysis, when stored properly
Storage
Store at -20 °C
Alpha
D21 +18.28° (c = 2.18 in alc)
Form
Powder
MDL
MFCD01673508
Packaging
5 mg
pKa
12.82±0.70(Predicted)
Refractive Index
1.5960 (estimate)
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