Vitas-M small molecule compound

methyl 3-(4-hydroxy-2-oxo-2H-chromen-3-yl)-5-methylhexanoate

Catalog ID
STL544666
SMILES COC(=O)CC(c1c(=O)oc2c(c1O)cccc2)CC(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 C17H20O5 MW 304.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20O5/c1-10(2)8-11(9-14(18)21-3)15-16(19)12-6-4-5-7-13(12)22-17(15)20/h4-7,10-11,19H,8-9H2,1-3H3
InChIKey
NVVMINTWMKUVRS-UHFFFAOYSA-N
Synonyms
1630853-32-5
1630853325
91637234
InChI=1SC17H20O5c110(2)811(914(18)213)1516(19)12645713(12)2217(15)20h47101119H89H213H3
methyl3(4hydroxy2oxo2Hchromen3yl)5methylhexanoate
METHYL3(4HYDROXY2OXOCHROMEN3YL)5METHYLHEXANOATE
MFCD28349223
ZINC000217715469
ZINC000217715550

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Available files

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