Vitas-M small molecule compound

3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-4-methylpentanoic acid

Catalog ID
STL552284
SMILES OC(=O)CC(c1oc(C)cc(=O)c1O)C(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 C12H16O5 MW 240.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16O5/c1-6(2)8(5-10(14)15)12-11(16)9(13)4-7(3)17-12/h4,6,8,16H,5H2,1-3H3,(H,14,15)
InChIKey
NUFZEIIWXGYLGF-UHFFFAOYSA-N
Synonyms

135640544
3(3hydroxy6methyl4oxo4Hpyran2yl)4methylpentanoicacid
3(3hydroxy6methyl4oxopyran2yl)4methylpentanoicacid
InChI=1SC12H16O5c16(2)8(510(14)15)1211(16)9(13)47(3)1712h46816H5H213H3(H1415)
ZINC001547139343
ZINC001547139344

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Available files

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