Vitas-M small molecule compound

methyl {7-hydroxy-4-methyl-8-[(3-methylpiperidin-1-yl)methyl]-2-oxo-2H-chromen-3-yl}acetate

Catalog ID
STK716705
SMILES COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2CN1CCCC(C1)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 C20H25NO5 MW 359.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO5/c1-12-5-4-8-21(10-12)11-16-17(22)7-6-14-13(2)15(9-18(23)25-3)20(24)26-19(14)16/h6-7,12,22H,4-5,8-11H2,1-3H3
InChIKey
KOAGEOMHLJIDSC-UHFFFAOYSA-N
Synonyms
887862-19-3
(7HYDROXY4METHYL8(3METHYLPIPERIDIN1YLMETHYL)2OXO2HCHROMEN3YL)ACETICACIDMETHYLESTER
2(7HYDROXY2KETO4METHYL8((3METHYLPIPERIDINO)METHYL)CHROMEN3YL)ACETICACIDMETHYLESTER
2(7HYDROXY4METHYL8((3METHYL1PIPERIDINYL)METHYL)2OXO1BENZOPYRAN3YL)ACETICACIDMETHYLESTER
887862193
CC1CCCN(C1)CC2=C(C=CC3=C2OC(=O)C(=C3C)CC(=O)OC)O
InChI=1SC20H25NO5c11254821(1012)111617(22)761413(2)15(918(23)253)20(24)2619(14)16h671222H45811H213H3
methyl(7hydroxy4methyl8((3methylpiperidin1yl)methyl)2oxo2Hchromen3yl)acetate
METHYL2(4METHYL8((3METHYLPIPERIDIN1YL)METHYL)7OXIDANYL2OXIDANYLIDENECHROMEN3YL)ETHANOATE
methyl2(7hydroxy4methyl8((3methylpiperidin1yl)methyl)2oxo2Hchromen3yl)acetate
METHYL2(7HYDROXY4METHYL8((3METHYLPIPERIDIN1YL)METHYL)2OXOCHROMEN3YL)ACETATE
MFCD03852955
ZINC000002212787
ZINC000002212790

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.