Vitas-M small molecule compound

methyl 4-[(Z)-{6-hydroxy-7-[(4-methylpiperidin-1-yl)methyl]-3-oxo-1-benzofuran-2(3H)-ylidene}methyl]benzoate

Catalog ID
STL033557
SMILES COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2CN1CCC(CC1)C)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 C24H25NO5 MW 407.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO5/c1-15-9-11-25(12-10-15)14-19-20(26)8-7-18-22(27)21(30-23(18)19)13-16-3-5-17(6-4-16)24(28)29-2/h3-8,13,15,26H,9-12,14H2,1-2H3/b21-13-
InChIKey
CGAQMPSMRPVFTK-BKUYFWCQSA-N
Synonyms
869078-04-6
869078046
CC1CCN(CC1)CC2=C(C=CC3=C2OC(=CC4=CC=C(C=C4)C(=O)OC)C3=O)O
COC(=O)c1ccc(cc1)C=C1Oc2c(C1=O)ccc(c2CN1CCC(CC1)C)O
InChI=1SC24H25NO5c11591125(121015)141920(26)871822(27)21(3023(18)19)13163517(6416)24(28)292h38131526H91214H212H3b2113
METHYL4((6HYDROXY7((4METHYLPIPERIDYL)METHYL)3OXOBENZO(D)FURAN2YLIDENE)METHYL)BENZOATE
methyl4((Z)(6hydroxy7((4methylpiperidin1yl)methyl)3oxo1benzofuran2(3H)ylidene)methyl)benzoate
METHYL4((Z)(6HYDROXY7((4METHYLPIPERIDIN1YL)METHYL)3OXO1BENZOFURAN2YLIDENE)METHYL)BENZOATE
MFCD06737474
ZINC000017245918
ZINC17245918

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Available files

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