Vitas-M small molecule compound
4-{5-[1-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-3-methoxy-3-oxopropyl]furan-2-yl}benzoic acid
Catalog ID
STL539582
SMILES COC(=O)CC(c1oc(C)cc(=O)c1O)c1ccc(o1)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 C21H18O8 MW 398.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18O8/c1-11-9-15(22)19(24)20(28-11)14(10-18(23)27-2)17-8-7-16(29-17)12-3-5-13(6-4-12)21(25)26/h3-9,14,24H,10H2,1-2H3,(H,25,26)InChIKey
XMWCZBQHNCUYKM-UHFFFAOYSA-NSynonyms
1574473-37-21574473372
4(5(1(3hydroxy6methyl4oxo4Hpyran2yl)3methoxy3oxopropyl)furan2yl)benzoicacid
4(5(1(3hydroxy6methyl4oxopyran2yl)3methoxy3oxopropyl)furan2yl)benzoicacid
71826582
InChI=1SC21H18O8c111915(22)19(24)20(2811)14(1018(23)272)178716(2917)123513(6412)21(25)26h391424H10H212H3(H2526)
MFCD28051253
ZINC000096114938
ZINC000096114939
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