Vitas-M small molecule compound
methyl 3-(3-hydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-3-(3-hydroxy-4-methoxyphenyl)propanoate
Catalog ID
STL543772
SMILES COC(=O)CC(C1=C(O)C(=O)c2c(C1=O)cccc2)c1ccc(c(c1)O)OC
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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 C21H18O7 MW 382.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18O7/c1-27-16-8-7-11(9-15(16)22)14(10-17(23)28-2)18-19(24)12-5-3-4-6-13(12)20(25)21(18)26/h3-9,14,22,26H,10H2,1-2H3InChIKey
YUYHJEGIMFRSBR-UHFFFAOYSA-NSynonyms
InChI=1SC21H18O7c127168711(915(16)22)14(1017(23)282)1819(24)12534613(12)20(25)21(18)26h39142226H10H212H3
methyl3(3hydroxy14dioxo14dihydronaphthalen2yl)3(3hydroxy4methoxyphenyl)propanoate
MFCD28349679
ZINC000217821188
ZINC000217821269
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