Vitas-M small molecule compound

3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(2,6-dimethylpiperidin-1-yl)methyl]-7-hydroxy-4H-chromen-4-one

Catalog ID
STK923051
SMILES CC1CCCC(N1Cc1c(O)ccc2c1occ(c2=O)c1ccc2c(c1)OCCO2)C

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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 C25H27NO5 MW 421.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO5/c1-15-4-3-5-16(2)26(15)13-19-21(27)8-7-18-24(28)20(14-31-25(18)19)17-6-9-22-23(12-17)30-11-10-29-22/h6-9,12,14-16,27H,3-5,10-11,13H2,1-2H3
InChIKey
RSYYLZFWVUFPHU-UHFFFAOYSA-N
Synonyms
637751-82-7
3(23DIHYDRO14BENZODIOXIN6YL)8((26DIMETHYLPIPERIDIN1IUM1YL)METHYL)4OXOCHROMEN7OLATE
3(23dihydro14benzodioxin6yl)8((26dimethylpiperidin1yl)methyl)7hydroxy4Hchromen4one
3(23DIHYDRO14BENZODIOXIN6YL)8((26DIMETHYLPIPERIDIN1YL)METHYL)7HYDROXYCHROMEN4ONE
3(23DIHYDROBENZO(B)(14)DIOXIN6YL)8((26DIMETHYLPIPERIDIN1YL)METHYL)7HYDROXY4HCHROMEN4ONE
3(2H3HBENZO(34E)14DIOXAN6YL)8((26DIMETHYLPIPERIDYL)METHYL)7HYDROXYCHROMEN4ONE
637751827
CC1CCCC(N1CC2=C(C=CC3=C2OC=C(C3=O)C4=CC5=C(C=C4)OCCO5)O)C
InChI=1SC25H27NO5c11543516(2)26(15)131921(27)871824(28)20(143125(18)19)17692223(1217)3011102922h6912141627H35101113H212H3
MFCD04163571
ZINC000013768312
ZINC000020358373

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Available files

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