Vitas-M small molecule compound
2-[5-(1-{4-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-6-methyl-2-oxo-1,2-dihydropyridin-3-yl}-3-methoxy-3-oxopropyl)furan-2-yl]benzoic acid
Catalog ID
STL542974
SMILES COC(=O)CC(c1c(O)cc(n(c1=O)CCc1c[nH]c2c1cccc2)C)c1ccc(o1)c1ccccc1C(=O)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 C31H28N2O7 MW 540.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N2O7/c1-18-15-25(34)29(30(36)33(18)14-13-19-17-32-24-10-6-5-7-20(19)24)23(16-28(35)39-2)27-12-11-26(40-27)21-8-3-4-9-22(21)31(37)38/h3-12,15,17,23,32,34H,13-14,16H2,1-2H3,(H,37,38)InChIKey
FPFZSOXKLFLHKW-UHFFFAOYSA-NSynonyms
110206076
2(5(1(1(2(1HINDOL3YL)ETHYL)4HYDROXY6METHYL2OXO12DIHYDROPYRIDIN3YL)3METHOXY3OXOPROPYL)FURAN2YL)BENZOICACID
2(5(1(4hydroxy1(2(1~(H)indol3yl)ethyl)6methyl2oxopyridin3yl)3methoxy3oxopropyl)furan2yl)benzoicacid
2(5(1(4hydroxy1(2(1Hindol3yl)ethyl)6methyl2oxo12dihydropyridin3yl)3methoxy3oxopropyl)furan2yl)benzoicacid
COC(=O)CC(c1c(O)cc(n(c1=O)CCc1c(nH)c2c1cccc2)C)c1ccc(o1)c1ccccc1C(=O)O
InChI=1SC31H28N2O7c1181525(34)29(30(36)33(18)1413191732241065720(19)24)23(1628(35)392)27121126(4027)21834922(21)31(37)38h3121517233234H131416H212H3(H3738)
MFCD29055519
ZINC000253401427
ZINC000253401430
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