Vitas-M small molecule compound
methyl 3-(3,4-dihydroxy-5-methoxyphenyl)-3-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)propanoate
Catalog ID
STL539180
SMILES COC(=O)CC(c1c(O)n[nH]c1C)c1cc(O)c(c(c1)OC)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 C15H18N2O6 MW 322.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O6/c1-7-13(15(21)17-16-7)9(6-12(19)23-3)8-4-10(18)14(20)11(5-8)22-2/h4-5,9,18,20H,6H2,1-3H3,(H2,16,17,21)InChIKey
XZFVWRHHYJIQOL-UHFFFAOYSA-NSynonyms
1435989-39-11435989391
71755284
InChI=1SC15H18N2O6c1713(15(21)17167)9(612(19)233)8410(18)14(20)11(58)222h4591820H6H213H3(H2161721)
methyl3(34dihydroxy5methoxyphenyl)3(3hydroxy5methyl1Hpyrazol4yl)propanoate
methyl3(34dihydroxy5methoxyphenyl)3(3methyl5oxo12dihydropyrazol4yl)propanoate
METHYL3(34DIHYDROXY5METHOXYPHENYL)3(5METHYL3OXO23DIHYDRO1HPYRAZOL4YL)PROPANOATE
MFCD31754782
ZINC000085879738
ZINC000085879746
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.