Vitas-M small molecule compound
3-{2,4-dihydroxy-6-[4-(propan-2-yl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-5-yl}-4-hydroxy-6-methyl-2H-pyran-2-one
Catalog ID
STL523587
SMILES Oc1nc(O)c2c(n1)[nH]c(c2c1c(O)cc(oc1=O)C)c1ccc(cc1)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 C21H19N3O5 MW 393.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O5/c1-9(2)11-4-6-12(7-5-11)17-15(14-13(25)8-10(3)29-20(14)27)16-18(22-17)23-21(28)24-19(16)26/h4-9,25H,1-3H3,(H3,22,23,24,26,28)InChIKey
RNHFNUODCCZYPG-UHFFFAOYSA-NSynonyms
127253042
3(24dihydroxy6(4(propan2yl)phenyl)7Hpyrrolo(23d)pyrimidin5yl)4hydroxy6methyl2Hpyran2one
5(4hydroxy6methyl2oxopyran3yl)6(4propan2ylphenyl)17dihydropyrrolo(23d)pyrimidine24dione
InChI=1SC21H19N3O5c19(2)114612(7511)1715(1413(25)810(3)2920(14)27)1618(2217)2321(28)2419(16)26h4925H13H3(H32223242628)
MFCD31753019
ZINC000604405594
ZINC604405594
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