Vitas-M small molecule compound
methyl 3-(3-hydroxy-4-methoxyphenyl)-3-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)propanoate
Catalog ID
STL311922
SMILES COC(=O)CC(c1c(O)n[nH]c1C)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 C15H18N2O5 MW 306.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O5/c1-8-14(15(20)17-16-8)10(7-13(19)22-3)9-4-5-12(21-2)11(18)6-9/h4-6,10,18H,7H2,1-3H3,(H2,16,17,20)InChIKey
WMLGHZAQYJPQCP-UHFFFAOYSA-NSynonyms
1401560-21-11401560211
CC1=C(C(=O)NN1)C(CC(=O)OC)C2=CC(=C(C=C2)OC)O
COC(=O)CC(c1c(O)n(nH)c1C)c1ccc(c(c1)O)OC
InChI=1SC15H18N2O5c1814(15(20)17168)10(713(19)223)94512(212)11(18)69h461018H7H213H3(H2161720)
methyl3(3hydroxy4methoxyphenyl)3(3hydroxy5methyl1Hpyrazol4yl)propanoate
methyl3(3hydroxy4methoxyphenyl)3(3methyl5oxo12dihydropyrazol4yl)propanoate
MFCD28026372
ZINC000079481869
ZINC000079481873
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