Vitas-M small molecule compound

7-hydroxy-4-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2H-chromen-2-one

Catalog ID
STL548540
SMILES Oc1ccc2c(c1)oc(=O)cc2CC(=O)N1CCC2(C(C1)CCCC2)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 C20H23NO5 MW 357.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO5/c22-15-4-5-16-13(10-19(24)26-17(16)11-15)9-18(23)21-8-7-20(25)6-2-1-3-14(20)12-21/h4-5,10-11,14,22,25H,1-3,6-9,12H2
InChIKey
NDCKGNPLTQBZIY-UHFFFAOYSA-N
Synonyms

4(2(4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)2oxoethyl)7hydroxychromen2one
5926647
7hydroxy4(2(4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethyl)2Hchromen2one
InChI=1SC20H23NO5c2215451613(1019(24)2617(16)1115)918(23)218720(25)621314(20)1221h451011142225H136912H2
MFCD31756775
ZINC000002109212
ZINC000015954260

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Available files

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