Vitas-M small molecule compound
methyl 3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-3-[1-(propan-2-yl)-1H-pyrazol-4-yl]propanoate
Catalog ID
STL315880
SMILES COC(=O)CC(c1oc(C)cc(=O)c1O)c1cnn(c1)C(C)C
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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 C16H20N2O5 MW 320.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O5/c1-9(2)18-8-11(7-17-18)12(6-14(20)22-4)16-15(21)13(19)5-10(3)23-16/h5,7-9,12,21H,6H2,1-4H3InChIKey
XGJDMMHSDITRMV-UHFFFAOYSA-NSynonyms
1574481-20-11574481201
CC1=CC(=O)C(=C(O1)C(CC(=O)OC)C2=CN(N=C2)C(C)C)O
InChI=1SC16H20N2O5c19(2)18811(71718)12(614(20)224)1615(21)13(19)510(3)2316h5791221H6H214H3
methyl3(3hydroxy6methyl4oxo4Hpyran2yl)3(1(propan2yl)1Hpyrazol4yl)propanoate
methyl3(3hydroxy6methyl4oxo4Hpyran2yl)3(1isopropyl1Hpyrazol4yl)propanoate
methyl3(3hydroxy6methyl4oxopyran2yl)3(1propan2ylpyrazol4yl)propanoate
MFCD28027506
ZINC000095477349
ZINC000095477350
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