Vitas-M small molecule compound
4-[1-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-3-methoxy-3-oxopropyl]benzoic acid
Catalog ID
STL539408
SMILES COC(=O)CC(c1oc(C)cc(=O)c1O)c1ccc(cc1)C(=O)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 C17H16O7 MW 332.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16O7/c1-9-7-13(18)15(20)16(24-9)12(8-14(19)23-2)10-3-5-11(6-4-10)17(21)22/h3-7,12,20H,8H2,1-2H3,(H,21,22)InChIKey
FXDJUSFHASXVLH-UHFFFAOYSA-NSynonyms
1574405-96-11574405961
4(1(3hydroxy6methyl4oxo4Hpyran2yl)3methoxy3oxopropyl)benzoicacid
4(1(3hydroxy6methyl4oxopyran2yl)3methoxy3oxopropyl)benzoicacid
71827385
InChI=1SC17H16O7c19713(18)15(20)16(249)12(814(19)232)103511(6410)17(21)22h371220H8H212H3(H2122)
MFCD28050591
ZINC000096113751
ZINC000096113752
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