Vitas-M small molecule compound
7-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-1-(3-methoxyphenyl)-5-oxo-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid
Catalog ID
STL435315
SMILES COc1cccc(c1)n1cc(c2c1C(CC(=O)N2)c1cc(OC)c2c(c1OC)OCO2)C(=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 C24H22N2O8 MW 466.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O8/c1-30-13-6-4-5-12(7-13)26-10-16(24(28)29)19-20(26)14(9-18(27)25-19)15-8-17(31-2)22-23(21(15)32-3)34-11-33-22/h4-8,10,14H,9,11H2,1-3H3,(H,25,27)(H,28,29)InChIKey
LMLISZVAIGQGSP-UHFFFAOYSA-NSynonyms
7(47dimethoxy13benzodioxol5yl)1(3methoxyphenyl)5oxo4567tetrahydro1Hpyrrolo(32b)pyridine3carboxylicacid
7(47dimethoxy13benzodioxol5yl)1(3methoxyphenyl)5oxo67dihydro4Hpyrrolo(32b)pyridine3carboxylicacid
COC1=CC=CC(=C1)N2C=C(C3=C2C(CC(=O)N3)C4=CC(=C5C(=C4OC)OCO5)OC)C(=O)O
InChI=1SC24H22N2O8c1301364512(713)261016(24(28)29)1920(26)14(918(27)2519)15817(312)2223(21(15)323)34113322h481014H911H213H3(H2527)(H2829)
MFCD25975197
ZINC000066087485
ZINC000066087487
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