Vitas-M small molecule compound
methyl 3-(4-butyl-6,7-dihydroxy-2-oxo-2H-chromen-8-yl)-3-(5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinolin-6-yl)propanoate
Catalog ID
STL561781
SMILES CCCCc1cc(=O)oc2c1cc(O)c(c2C(c1cc2cccc3c2n(c1=O)CCC3)CC(=O)OC)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 C29H29NO7 MW 503.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29NO7/c1-3-4-7-17-13-24(33)37-28-19(17)14-22(31)27(34)25(28)20(15-23(32)36-2)21-12-18-9-5-8-16-10-6-11-30(26(16)18)29(21)35/h5,8-9,12-14,20,31,34H,3-4,6-7,10-11,15H2,1-2H3InChIKey
MXJDKBLUZFFWMW-UHFFFAOYSA-NSynonyms
145705137
InChI=1SC29H29NO7c1347171324(33)372819(17)1422(31)27(34)25(28)20(1523(32)362)211218958161061130(26(16)18)29(21)35h5891214203134H3467101115H212H3
methyl3(4butyl67dihydroxy2oxo2Hchromen8yl)3(3oxo3567tetrahydropyrido(321ij)quinolin2yl)propanoate
methyl3(4butyl67dihydroxy2oxo2Hchromen8yl)3(5oxo23dihydro1H5Hpyrido(321ij)quinolin6yl)propanoate
methyl3(4butyl67dihydroxy2oxochromen8yl)3(2oxo1azatricyclo(7310513)trideca35(13)68tetraen3yl)propanoate
MFCD32650846
ZINC001848442881
ZINC001848442882
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