Vitas-M small molecule compound

2-(morpholin-4-ium-4-yl)-5-[(3,4,5-trimethoxybenzyl)amino]benzoate

Catalog ID
STK597753
SMILES COc1cc(CNc2ccc(c(c2)C(=O)[O-])[NH+]2CCOCC2)cc(c1OC)OC

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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 C21H26N2O6 MW 402.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O6/c1-26-18-10-14(11-19(27-2)20(18)28-3)13-22-15-4-5-17(16(12-15)21(24)25)23-6-8-29-9-7-23/h4-5,10-12,22H,6-9,13H2,1-3H3,(H,24,25)
InChIKey
YACMFAATTMTIHT-UHFFFAOYSA-N
Synonyms
765934-00-7
COc1cc(CNc2ccc(c(c2)C(=O)(O))(NH+)2CCOCC2)cc(c1OC)OC
MFCD06600974
ZINC000004386316

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Available files

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