Vitas-M small molecule compound
1-cyclohexyl-4-{4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-1H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridine-3,6,7-triol
Catalog ID
STL522296
SMILES CC(=C)COc1ccc(cc1)c1c2oc3c(c2nc2c1c(O)nn2C1CCCCC1)ccc(c3O)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 C28H27N3O5 MW 485.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O5/c1-15(2)14-35-18-10-8-16(9-11-18)21-22-27(31(30-28(22)34)17-6-4-3-5-7-17)29-23-19-12-13-20(32)24(33)25(19)36-26(21)23/h8-13,17,32-33H,1,3-7,14H2,2H3,(H,30,34)InChIKey
IPCSEALPJKCQLB-UHFFFAOYSA-NSynonyms
1cyclohexyl4(4((2methylprop2en1yl)oxy)phenyl)1H(1)benzofuro(32b)pyrazolo(43e)pyridine367triol
InChI=1SC28H27N3O5c115(2)14351810816(91118)212227(31(3028(22)34)176435717)292319121320(32)24(33)25(19)3626(21)23h813173233H13714H22H3(H3034)
MFCD31752536
ZINC000096116075
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