Vitas-M small molecule compound
methyl 3-(7-hydroxy-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-8-yl)-3-{4-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-6-methyl-2-oxo-1,2-dihydropyridin-3-yl}propanoate
Catalog ID
STL547885
SMILES COC(=O)CC(c1c(O)cc(n(c1=O)CCc1c[nH]c2c1cccc2)C)c1cc2cc3OCCOc3cc2nc1O
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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 C31H29N3O7 MW 555.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O7/c1-17-11-25(35)29(31(38)34(17)8-7-18-16-32-23-6-4-3-5-20(18)23)21(14-28(36)39-2)22-12-19-13-26-27(41-10-9-40-26)15-24(19)33-30(22)37/h3-6,11-13,15-16,21,32,35H,7-10,14H2,1-2H3,(H,33,37)InChIKey
VIIMPTPAPYJURT-UHFFFAOYSA-NSynonyms
110206618
InChI=1SC31H29N3O7c1171125(35)29(31(38)34(17)8718163223643520(18)23)21(1428(36)392)221219132627(411094026)1524(19)3330(22)37h3611131516213235H71014H212H3(H3337)
methyl3(4hydroxy1(2(1~(H)indol3yl)ethyl)6methyl2oxopyridin3yl)3(7oxo36dihydro2~(H)(14)dioxino(23g)quinolin8yl)propanoate
methyl3(7hydroxy23dihydro(14)dioxino(23g)quinolin8yl)3(4hydroxy1(2(1Hindol3yl)ethyl)6methyl2oxo12dihydropyridin3yl)propanoate
MFCD31756658
ZINC000253623947
ZINC000253623948
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