Vitas-M small molecule compound

methyl 3-[3-hydroxy-6-(methoxymethyl)-4-oxo-4H-pyran-2-yl]-3-[4-(propan-2-yloxy)phenyl]propanoate

Catalog ID
STL539628
SMILES COCc1cc(=O)c(c(o1)C(c1ccc(cc1)OC(C)C)CC(=O)OC)O

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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 C20H24O7 MW 376.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24O7/c1-12(2)26-14-7-5-13(6-8-14)16(10-18(22)25-4)20-19(23)17(21)9-15(27-20)11-24-3/h5-9,12,16,23H,10-11H2,1-4H3
InChIKey
YVNYKEQRXADSJB-UHFFFAOYSA-N
Synonyms
1574482-93-1
1574482931
71826880
InChI=1SC20H24O7c112(2)26147513(6814)16(1018(22)254)2019(23)17(21)915(2720)11243h59121623H1011H214H3
methyl3(3hydroxy6(methoxymethyl)4oxo4Hpyran2yl)3(4(propan2yloxy)phenyl)propanoate
METHYL3(3HYDROXY6(METHOXYMETHYL)4OXO4HPYRAN2YL)3(4ISOPROPOXYPHENYL)PROPANOATE
methyl3(3hydroxy6(methoxymethyl)4oxopyran2yl)3(4propan2yloxyphenyl)propanoate
MFCD28051011
ZINC000096114504
ZINC000096114505

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Available files

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