Vitas-M small molecule compound

N-[4-(benzyloxy)-3-ethoxybenzyl]-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanamine

Catalog ID
STK510941
SMILES CCOc1cc(CNC(C23CC4CC(C3)CC(C2)C4)C)ccc1OCc1ccccc1

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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 C28H37NO2 MW 419.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37NO2/c1-3-30-27-14-22(9-10-26(27)31-19-21-7-5-4-6-8-21)18-29-20(2)28-15-23-11-24(16-28)13-25(12-23)17-28/h4-10,14,20,23-25,29H,3,11-13,15-19H2,1-2H3
InChIKey
LXDGMLFEJRPFLQ-UHFFFAOYSA-N
Synonyms

1(1ADAMANTYL)N((3ETHOXY4PHENYLMETHOXYPHENYL)METHYL)ETHANAMINE
CCOC1=C(C=CC(=C1)CNC(C)C23CC4CC(C2)CC(C4)C3)OCC5=CC=CC=C5
InChI=1SC28H37NO2c1330271422(91026(27)3119217546821)182920(2)2815231124(1628)1325(1223)1728h4101420232529H311131519H212H3
MFCD02768402
N(4(benzyloxy)3ethoxybenzyl)1(tricyclo(3311~37~)dec1yl)ethanamine
ZINC000004222994
ZINC000004222995

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Available files

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