Vitas-M small molecule compound

8-[5-(4-hydroxy-3-methoxyphenyl)-4-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-1H-imidazol-2-yl]-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one

Catalog ID
STL579474
SMILES COc1cc(ccc1O)c1[nH]c(nc1c1oc(C)cc(=O)c1O)c1cc2cc3OCCOc3cc2[nH]c1=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 C27H21N3O8 MW 515.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O8/c1-12-7-18(32)24(33)25(38-12)23-22(13-3-4-17(31)19(9-13)35-2)29-26(30-23)15-8-14-10-20-21(37-6-5-36-20)11-16(14)28-27(15)34/h3-4,7-11,31,33H,5-6H2,1-2H3,(H,28,34)(H,29,30)
InChIKey
XMQPERPZNORJLY-UHFFFAOYSA-N
Synonyms

8(4(4hydroxy3methoxyphenyl)5(3hydroxy6methyl4oxo4Hpyran2yl)1Himidazol2yl)23dihydro(14)dioxino(23g)quinolin7(6H)one
8(5(4hydroxy3methoxyphenyl)4(3hydroxy6methyl4oxo4Hpyran2yl)1Himidazol2yl)23dihydro(14)dioxino(23g)quinolin7(6H)one
COc1cc(ccc1O)c1nc((nH)c1c1oc(C)cc(=O)c1O)c1cc2cc3OCCOc3cc2(nH)c1=O
InChI=1SC27H21N3O8c112718(32)24(33)25(3812)2322(133417(31)19(913)352)2926(3023)15814102021(37653620)1116(14)2827(15)34h347113133H56H212H3(H2834)(H2930)
MFCD33397801

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Available files

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