Vitas-M small molecule compound
ethyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-7-hydroxy-8-[(2-methylpiperidin-1-yl)methyl]-4-oxo-4H-chromene-2-carboxylate
Catalog ID
STK553094
SMILES CCOC(=O)c1oc2c(CN3CCCCC3C)c(O)c(cc2c(=O)c1c1ccc2c(c1)OCCO2)CC
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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 C29H33NO7 MW 507.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33NO7/c1-4-18-14-20-26(32)24(19-9-10-22-23(15-19)36-13-12-35-22)28(29(33)34-5-2)37-27(20)21(25(18)31)16-30-11-7-6-8-17(30)3/h9-10,14-15,17,31H,4-8,11-13,16H2,1-3H3InChIKey
VESOEZFVHBRFHI-UHFFFAOYSA-NSynonyms
610759-60-9610759609
CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C(=O)OCC)C3=CC4=C(C=C3)OCCO4)CN5CCCCC5C)O
ethyl3(23dihydro14benzodioxin6yl)6ethyl7hydroxy8((2methylpiperidin1yl)methyl)4oxo4Hchromene2carboxylate
ETHYL3(23DIHYDRO14BENZODIOXIN6YL)6ETHYL7HYDROXY8((2METHYLPIPERIDIN1YL)METHYL)4OXOCHROMENE2CARBOXYLATE
ethyl3(23dihydrobenzo(b)(14)dioxin6yl)6ethyl7hydroxy8((2methylpiperidin1yl)methyl)4oxo4Hchromene2carboxylate
ETHYL3(2H3HBENZO(34E)14DIOXAN6YL)6ETHYL7HYDROXY8((2METHYLPIPERIDYL)METHYL)4OXOCHROMENE2CARBOXYLATE
InChI=1SC29H33NO7c1418142026(32)24(199102223(1519)3613123522)28(29(33)3452)3727(20)21(25(18)31)16301176817(30)3h91014151731H48111316H213H3
MFCD03671718
ZINC000009075551
ZINC000009075552
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