Vitas-M small molecule compound
(4aR)-5,7-dihydroxy-8-(4-hydroxy-1-methyl-2-oxo-1,2-dihydropyrido[2,3-d]pyrimidin-7-yl)-1-(4-methoxyphenyl)-3,4a,6-trimethyl-1,4a-dihydro-4H-[1]benzofuro[3,2-f]indazol-4-one
Catalog ID
STL561722
SMILES COc1ccc(cc1)n1nc(c2c1C=C1Oc3c([C@]1(C2=O)C)c(O)c(c(c3c1ccc2c(n1)n(C)c(=O)nc2O)O)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 C31H25N5O7 MW 579.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25N5O7/c1-13-24(37)22(18-11-10-17-28(32-18)35(4)30(41)33-29(17)40)26-23(25(13)38)31(3)20(43-26)12-19-21(27(31)39)14(2)34-36(19)15-6-8-16(42-5)9-7-15/h6-12,37-38H,1-5H3,(H,33,40,41)/t31-/m0/s1InChIKey
NQZFYNUGPPCXMT-HKBQPEDESA-NSynonyms
(4aR)57dihydroxy8(4hydroxy1methyl2oxo12dihydropyrido(23d)pyrimidin7yl)1(4methoxyphenyl)34a6trimethyl14adihydro4H(1)benzofuro(32f)indazol4one
(4aR)57dihydroxy8(4hydroxy1methyl2oxopyrido(23d)pyrimidin7yl)1(4methoxyphenyl)34a6trimethyl(1)benzofuro(32f)indazol4one
145705078
InChI=1SC31H25N5O7c11324(37)22(1811101728(3218)35(4)30(41)3329(17)40)2623(25(13)38)31(3)20(4326)121921(27(31)39)14(2)3436(19)156816(425)9715h6123738H15H3(H334041)t31m0s1
MFCD32650787
ZINC001848442894
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