Vitas-M small molecule compound
4-(4-hydroxy-3-methoxy-5-nitrophenyl)-3-methyl-1,4,7,8-tetrahydro-5H-furo[3,4-b]pyrazolo[4,3-e]pyridin-5-one
Catalog ID
STK354553
SMILES COc1cc(cc(c1O)[N+](=O)[O-])C1C2=C(COC2=O)Nc2c1c(C)n[nH]2
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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 C16H14N4O6 MW 358.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O6/c1-6-11-12(7-3-9(20(23)24)14(21)10(4-7)25-2)13-8(5-26-16(13)22)17-15(11)19-18-6/h3-4,12,21H,5H2,1-2H3,(H2,17,18,19)InChIKey
KMIXOKHADKEWIE-UHFFFAOYSA-NSynonyms
4(4hydroxy3methoxy5nitrophenyl)3methyl1478tetrahydro5Hfuro(34b)pyrazolo(43e)pyridin5one
CC1=C2C(C3=C(COC3=O)N=C2NN1)C4=CC(=C(C(=C4)OC)O)(N+)(=O)(O)
COc1cc(cc(c1O)(N+)(=O)(O))C1C2=C(COC2=O)Nc2c1c(C)n(nH)2
InChI=1SC16H14N4O6c161112(739(20(23)24)14(21)10(47)252)138(52616(13)22)1715(11)19186h341221H5H212H3(H2171819)
MFCD11851725
ZINC000020086521
ZINC000020086524
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