Vitas-M small molecule compound

N-[4-(dimethylamino)benzyl]-3-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)propanamide

Catalog ID
STL551073
SMILES COc1cc(ccc1O)C(c1oc(C)cc(=O)c1O)CC(=O)NCc1ccc(cc1)N(C)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 C25H28N2O6 MW 452.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O6/c1-15-11-21(29)24(31)25(33-15)19(17-7-10-20(28)22(12-17)32-4)13-23(30)26-14-16-5-8-18(9-6-16)27(2)3/h5-12,19,28,31H,13-14H2,1-4H3,(H,26,30)
InChIKey
LHSAJHPIVRRGBY-UHFFFAOYSA-N
Synonyms

~(N)((4(dimethylamino)phenyl)methyl)3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxopyran2yl)propanamide
129895647
InChI=1SC25H28N2O6c1151121(29)24(31)25(3315)19(1771020(28)22(1217)324)1323(30)2614165818(9616)27(2)3h512192831H1314H214H3(H2630)
MFCD31757932
N(4(dimethylamino)benzyl)3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)propanamide
ZINC000524731141
ZINC000524731142

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Available files

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