Vitas-M small molecule compound

methyl 3-(3-hydroxy-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-4-oxo-4H-pyran-2-yl)-3-(pyridin-3-yl)propanoate

Catalog ID
STL492099
SMILES COC(=O)CC(c1oc(CN2CCN(CC2)c2ccc(cc2)OC)cc(=O)c1O)c1cccnc1

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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 C26H29N3O6 MW 479.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O6/c1-33-20-7-5-19(6-8-20)29-12-10-28(11-13-29)17-21-14-23(30)25(32)26(35-21)22(15-24(31)34-2)18-4-3-9-27-16-18/h3-9,14,16,22,32H,10-13,15,17H2,1-2H3
InChIKey
VPPPQRIPLPXWDT-UHFFFAOYSA-N
Synonyms

COC1=CC=C(C=C1)N2CCN(CC2)CC3=CC(=O)C(=C(O3)C(CC(=O)OC)C4=CN=CC=C4)O
InChI=1SC26H29N3O6c133207519(6820)29121028(111329)17211423(30)25(32)26(3521)22(1524(31)342)18439271618h3914162232H10131517H212H3
methyl3(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxo4Hpyran2yl)3(pyridin3yl)propanoate
methyl3(3hydroxy6((4(4methoxyphenyl)piperazin1yl)methyl)4oxopyran2yl)3pyridin3ylpropanoate
MFCD29056963
ZINC000253413760
ZINC000253413761

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Available files

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