INDACONITINE

Inquiry

For Research Use Only.

Size	Price	Stock	Quantity
5 mg	$299	In stock

Category

Alkaloids

Cat.No.

NP0087

CAS

4491-19-4

Product Name

INDACONITINE

Structure

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℃

Purity

>98%

Density

1.33 g/cm3

Solubility

Soluble in DMSO