Vitas-M small molecule compound

ethyl 1-[3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoyl]piperidine-3-carboxylate

Catalog ID
STL237334
SMILES CCOC(=O)C1CCCN(C1)C(=O)CCc1c(=O)oc2c(c1C)ccc(c2C)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 C22H27NO6 MW 401.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO6/c1-4-28-21(26)15-6-5-11-23(12-15)19(25)10-8-17-13(2)16-7-9-18(24)14(3)20(16)29-22(17)27/h7,9,15,24H,4-6,8,10-12H2,1-3H3
InChIKey
LUERCRURCHWIEZ-UHFFFAOYSA-N
Synonyms
929824-41-9
929824419
CCOC(=O)C1CCCN(C1)C(=O)CCC2=C(C3=C(C(=C(C=C3)O)C)OC2=O)C
ethyl1(3(7hydroxy48dimethyl2oxo2Hchromen3yl)propanoyl)piperidine3carboxylate
ethyl1(3(7hydroxy48dimethyl2oxochromen3yl)propanoyl)piperidine3carboxylate
InChI=1SC22H27NO6c142821(26)15651123(1215)19(25)1081713(2)167918(24)14(3)20(16)2922(17)27h791524H4681012H213H3
MFCD09845339
ZINC000009486488
ZINC000009486490

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Available files

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