Vitas-M small molecule compound

methyl 3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-3-{4-[(2-methylprop-2-en-1-yl)oxy]phenyl}propanoate

Catalog ID
STL540229
SMILES COC(=O)CC(c1oc(C)cc(=O)c1O)c1ccc(cc1)OCC(=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 C20H22O6 MW 358.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22O6/c1-12(2)11-25-15-7-5-14(6-8-15)16(10-18(22)24-4)20-19(23)17(21)9-13(3)26-20/h5-9,16,23H,1,10-11H2,2-4H3
InChIKey
UIDXLGCSPCFYSC-UHFFFAOYSA-N
Synonyms
1574484-39-1
1574484391
71826755
InChI=1SC20H22O6c112(2)1125157514(6815)16(1018(22)244)2019(23)17(21)913(3)2620h591623H11011H224H3
METHYL3(3HYDROXY6METHYL4OXO4HPYRAN2YL)3(4((2METHYLALLYL)OXY)PHENYL)PROPANOATE
methyl3(3hydroxy6methyl4oxo4Hpyran2yl)3(4((2methylprop2en1yl)oxy)phenyl)propanoate
methyl3(3hydroxy6methyl4oxopyran2yl)3(4(2methylprop2enoxy)phenyl)propanoate
MFCD28051110
ZINC000096114691
ZINC000096114692

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Available files

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