Vitas-M small molecule compound
3-hydroxy-6-methyl-2-{[4-(2,3,4-trimethoxybenzyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Catalog ID
STL319500
SMILES COc1c(ccc(c1OC)OC)CN1CCN(CC1)Cc1oc(C)cc(=O)c1O
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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 C21H28N2O6 MW 404.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O6/c1-14-11-16(24)19(25)18(29-14)13-23-9-7-22(8-10-23)12-15-5-6-17(26-2)21(28-4)20(15)27-3/h5-6,11,25H,7-10,12-13H2,1-4H3InChIKey
UTIRVTVAHZMIRU-UHFFFAOYSA-NSynonyms
1401577-49-81401577498
3hydroxy6methyl2((4((234trimethoxyphenyl)methyl)piperazin1yl)methyl)pyran4one
3hydroxy6methyl2((4(234trimethoxybenzyl)piperazin1yl)methyl)4Hpyran4one
CC1=CC(=O)C(=C(O1)CN2CCN(CC2)CC3=C(C(=C(C=C3)OC)OC)OC)O
InChI=1SC21H28N2O6c1141116(24)19(25)18(2914)13239722(81023)12155617(262)21(284)20(15)273h561125H7101213H214H3
MFCD22584540
ZINC000079496823
ZINC79496823
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