Vitas-M small molecule compound

3-(1,3-benzodioxol-5-yl)-N-(furan-2-ylmethyl)-6-methylheptan-1-amine

Catalog ID
STK600016
SMILES CC(CCC(c1ccc2c(c1)OCO2)CCNCc1ccco1)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H27NO3 MW 329.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27NO3/c1-15(2)5-6-16(9-10-21-13-18-4-3-11-22-18)17-7-8-19-20(12-17)24-14-23-19/h3-4,7-8,11-12,15-16,21H,5-6,9-10,13-14H2,1-2H3
InChIKey
UQAUOPVSUTUMKP-UHFFFAOYSA-N
Synonyms

(3S)3(13BENZODIOXOL5YL)N(FURAN2YLMETHYL)6METHYLHEPTAN1AMINE
3(13benzodioxol5yl)N(furan2ylmethyl)6methylheptan1amine
CC(C)CCC(CCNCC1=CC=CO1)C2=CC3=C(C=C2)OCO3
InChI=1SC20H27NO3c115(2)5616(91021131843112218)17781920(1217)24142319h34781112151621H569101314H212H3
MFCD06605161
ZINC000002323730
ZINC000002323732

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.