Vitas-M small molecule compound

methyl 3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]propanoate

Catalog ID
STL539608
SMILES COC(=O)CC(c1oc(C)cc(=O)c1O)c1ccc(c(c1)OC)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 C21H26O7 MW 390.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26O7/c1-12(2)11-27-17-7-6-14(9-18(17)25-4)15(10-19(23)26-5)21-20(24)16(22)8-13(3)28-21/h6-9,12,15,24H,10-11H2,1-5H3
InChIKey
CWKLCPBVIPDDGW-UHFFFAOYSA-N
Synonyms
1574492-39-9
1574492399
71826715
InChI=1SC21H26O7c112(2)1127177614(918(17)254)15(1019(23)265)2120(24)16(22)813(3)2821h69121524H1011H215H3
methyl3(3hydroxy6methyl4oxo4Hpyran2yl)3(3methoxy4(2methylpropoxy)phenyl)propanoate
METHYL3(3HYDROXY6METHYL4OXO4HPYRAN2YL)3(4ISOBUTOXY3METHOXYPHENYL)PROPANOATE
methyl3(3hydroxy6methyl4oxopyran2yl)3(3methoxy4(2methylpropoxy)phenyl)propanoate
MFCD28051147
ZINC000096114746
ZINC000096114747

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Available files

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