Vitas-M small molecule compound
3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-N-(4-methoxyphenyl)propanamide
Catalog ID
STL435022
SMILES COc1ccc(cc1)NC(=O)CC(c1cc(OC)c2c(c1OC)OCO2)c1c(O)cc(oc1=O)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 C25H25NO9 MW 483.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO9/c1-13-9-18(27)21(25(29)35-13)16(11-20(28)26-14-5-7-15(30-2)8-6-14)17-10-19(31-3)23-24(22(17)32-4)34-12-33-23/h5-10,16,27H,11-12H2,1-4H3,(H,26,28)InChIKey
NUFULBAISIGVPX-UHFFFAOYSA-NSynonyms
3(47dimethoxy13benzodioxol5yl)3(4hydroxy6methyl2oxo2Hpyran3yl)N(4methoxyphenyl)propanamide
3(47dimethoxy13benzodioxol5yl)3(4hydroxy6methyl2oxopyran3yl)N(4methoxyphenyl)propanamide
CC1=CC(=C(C(=O)O1)C(CC(=O)NC2=CC=C(C=C2)OC)C3=CC(=C4C(=C3OC)OCO4)OC)O
InChI=1SC25H25NO9c113918(27)21(25(29)3513)16(1120(28)26145715(302)8614)171019(313)2324(22(17)324)34123323h5101627H1112H214H3(H2628)
MFCD30711566
ZINC000253471213
ZINC000253471216
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