Vitas-M small molecule compound
methyl 3-[3-acetyl-2,6-dihydroxy-5-(7-hydroxy-6-methyl-1,3-dihydrofuro[3,4-c]pyridin-1-yl)phenyl]-3-(5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinolin-6-yl)propanoate
Catalog ID
STL549767
SMILES COC(=O)CC(c1cc2cccc3c2n(c1=O)CCC3)c1c(O)c(cc(c1O)C1OCc2c1c(O)c(nc2)C)C(=O)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 C32H30N2O8 MW 570.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N2O8/c1-15-28(37)25-19(13-33-15)14-42-31(25)23-11-20(16(2)35)29(38)26(30(23)39)21(12-24(36)41-3)22-10-18-7-4-6-17-8-5-9-34(27(17)18)32(22)40/h4,6-7,10-11,13,21,31,37-39H,5,8-9,12,14H2,1-3H3InChIKey
FYOBMJRYQCAUPJ-UHFFFAOYSA-NSynonyms
129895571
InChI=1SC32H30N2O8c11528(37)2519(133315)144231(25)231120(16(2)35)29(38)26(30(23)39)21(1224(36)413)2210187461785934(27(17)18)32(22)40h46710111321313739H5891214H213H3
methyl3(3acetyl26dihydroxy5(7hydroxy6methyl13dihydrofuro(34c)pyridin1yl)phenyl)3(2oxo1azatricyclo(7310^(513))trideca35(13)68tetraen3yl)propanoate
methyl3(3acetyl26dihydroxy5(7hydroxy6methyl13dihydrofuro(34c)pyridin1yl)phenyl)3(3oxo3567tetrahydropyrido(321ij)quinolin2yl)propanoate
methyl3(3acetyl26dihydroxy5(7hydroxy6methyl13dihydrofuro(34c)pyridin1yl)phenyl)3(5oxo23dihydro1H5Hpyrido(321ij)quinolin6yl)propanoate
MFCD31757190
ZINC000524730987
ZINC000524730990
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