Vitas-M small molecule compound

17-(2-methoxyphenyl)-15-methyl-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione (non-preferred name)

Catalog ID
STK252662
SMILES COc1ccccc1N1C(=O)C2C(C1=O)(C)C1c3c(C2c2c1cccc2)cccc3

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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 C26H21NO3 MW 395.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21NO3/c1-26-22-17-11-5-3-9-15(17)21(16-10-4-6-12-18(16)22)23(26)24(28)27(25(26)29)19-13-7-8-14-20(19)30-2/h3-14,21-23H,1-2H3
InChIKey
OCGLJNNAESWHFL-UHFFFAOYSA-N
Synonyms

17(2methoxyphenyl)15methyl17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CC12C(C3C4=CC=CC=C4C1C5=CC=CC=C35)C(=O)N(C2=O)C6=CC=CC=C6OC
InChI=1SC26H21NO3c12622171153915(17)21(1610461218(16)22)23(26)24(28)27(25(26)29)1913781420(19)302h3142123H12H3
MFCD02822228
ZINC000001183222
ZINC000001183225

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Available files

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