N-Demethylechitamine

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For Research Use Only.

Category

Alkaloids

Cat.No.

NP0216

CAS

60048-88-6

Product Name

N-Demethylechitamine

Structure

Product Details

Description

N-Demethylechitamine is an alkaloid isolated from Alstonia scholaris.

Synonyms

Methyl (1s,9r,10s,12s,13e)-13-ethylidene-10-hydroxy-18-(hydroxymethyl)-8,15-diazapentacyclo[10.5.1.01,9.02,7.09,15]octadeca-2,4,6-triene-18-carboxylate

Molecular Weight

370.449

Molecular Formula

C21H26N2O4

Canonical SMILES

CC=C1CN2CCC34C2(C(CC1C3(CO)C(=O)OC)O)NC5=CC=CC=C45

InChI

InChI=1S/C21H26N2O4/c1-3-13-11-23-9-8-20-14-6-4-5-7-16(14)22-21(20,23)17(25)10-15(13)19(20,12-24)18(26)27-2/h3-7,15,17,22,24-25H,8-12H2,1-2H3/b13-3-/t15-,17-,19?,20-,21-/m0/s1

InChIKey

VZZBVNLFHYEUHM-MEASUVLSSA-N

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