Vitas-M small molecule compound
17-(3-bromophenyl)-1-(dimethoxymethyl)-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
STK751400
SMILES COC(C12C3C(=O)N(C(=O)C3C(c3c1cccc3)c1c2cccc1)c1cccc(c1)Br)OC
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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 C27H22BrNO4 MW 504.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22BrNO4/c1-32-26(33-2)27-19-12-5-3-10-17(19)21(18-11-4-6-13-20(18)27)22-23(27)25(31)29(24(22)30)16-9-7-8-15(28)14-16/h3-14,21-23,26H,1-2H3InChIKey
UOSMXVNYNTUYBS-UHFFFAOYSA-NSynonyms
17(3bromophenyl)1(dimethoxymethyl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
COC(C12C3C(C(C4=CC=CC=C41)C5=CC=CC=C25)C(=O)N(C3=O)C6=CC(=CC=C6)Br)OC
InChI=1SC27H22BrNO4c13226(332)271912531017(19)21(1811461320(18)27)2223(27)25(31)29(24(22)30)1697815(28)1416h314212326H12H3
MFCD00684478
ZINC000000712657
ZINC000000712661
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