Vitas-M small molecule compound

methyl 3-[4-(acetyloxy)-3,5-dimethoxyphenyl]-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)propanoate

Catalog ID
STL543378
SMILES COC(=O)CC(c1c(O)cc(oc1=O)C)c1cc(OC)c(c(c1)OC)OC(=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 C20H22O9 MW 406.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22O9/c1-10-6-14(22)18(20(24)28-10)13(9-17(23)27-5)12-7-15(25-3)19(29-11(2)21)16(8-12)26-4/h6-8,13,22H,9H2,1-5H3
InChIKey
RIRZXGLDKALVIG-UHFFFAOYSA-N
Synonyms
1676085-34-9
102565129
1676085349
InChI=1SC20H22O9c110614(22)18(20(24)2810)13(917(23)275)12715(253)19(2911(2)21)16(812)264h681322H9H215H3
methyl3(4(acetyloxy)35dimethoxyphenyl)3(4hydroxy6methyl2oxo2Hpyran3yl)propanoate
METHYL3(4ACETOXY35DIMETHOXYPHENYL)3(4HYDROXY6METHYL2OXO2HPYRAN3YL)PROPANOATE
methyl3(4acetyloxy35dimethoxyphenyl)3(4hydroxy6methyl2oxopyran3yl)propanoate
MFCD28986007
ZINC000218113874
ZINC000218113944

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Available files

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