Vitas-M small molecule compound
3-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)-6,7-dimethoxy-2-benzofuran-1(3H)-one
Catalog ID
STL319595
SMILES COc1c(OC)ccc2c1C(=O)OC2c1c(C)[nH]nc1O
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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 C14H14N2O5 MW 290.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N2O5/c1-6-9(13(17)16-15-6)11-7-4-5-8(19-2)12(20-3)10(7)14(18)21-11/h4-5,11H,1-3H3,(H2,15,16,17)InChIKey
ZTGPMNANSKLDEQ-UHFFFAOYSA-NSynonyms
1014105-79-31014105793
3(3hydroxy5methyl1Hpyrazol4yl)67dimethoxy2benzofuran1(3H)one
3(5hydroxy3methyl1Hpyrazol4yl)67dimethoxyisobenzofuran1(3H)one
4(45dimethoxy3oxo1H2benzofuran1yl)5methyl12dihydropyrazol3one
CC1=C(C(=O)NN1)C2C3=C(C(=C(C=C3)OC)OC)C(=O)O2
COc1c(OC)ccc2c1C(=O)OC2c1c(C)(nH)nc1O
COc1c(OC)ccc2c1C(=O)OC2c1c(O)(nH)nc1C
InChI=1SC14H14N2O5c169(13(17)16156)117458(192)12(203)10(7)14(18)2111h4511H13H3(H2151617)
MFCD28031958
ZINC000009059883
ZINC000009059884
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