Alstoyunine E

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For Research Use Only.

Category

Alkaloids

Cat.No.

NP0483

CAS

1188932-15-1

Product Name

Alstoyunine E

Structure

Product Details

Description

Alstoyunine E is a natural alkaloid found in the herbs of Alstonia yunnanensis. Alstoyunine E exhibits selective inhibition of Cox-2.

Synonyms

Vinorine N4-oxide

IUPAC Name

[(1R,10S,12R,13E,16S,17S,18R)-13-ethylidene-15-oxido-8-aza-15-azoniahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate

Molecular Weight

350.4

Molecular Formula

C21H22N2O3

Canonical SMILES

CC=C1C[N+]2(C3CC1C4C2CC5(C4OC(=O)C)C3=NC6=CC=CC=C56)[O-]

InChI

InChI=1S/C21H22N2O3/c1-3-12-10-23(25)16-8-13(12)18-17(23)9-21(20(18)26-11(2)24)14-6-4-5-7-15(14)22-19(16)21/h3-7,13,16-18,20H,8-10H2,1-2H3/b12-3-/t13-,16-,17-,18-,20+,21+,23?/m0/s1

InChIKey

SYZGOUOZLCZRJD-TZUVUNOXSA-N

Purity

>97%

Appearance

Powder

Color

Orange

Form

Powder

pKa

4.15±0.40(Predicted)

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