Vitas-M small molecule compound
1-acetyl-17-(2-ethylphenyl)-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
STK326039
SMILES CCc1ccccc1N1C(=O)C2C(C1=O)C1(C(=O)C)c3c(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 C28H23NO3 MW 421.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23NO3/c1-3-17-10-4-9-15-22(17)29-26(31)24-23-18-11-5-7-13-20(18)28(16(2)30,25(24)27(29)32)21-14-8-6-12-19(21)23/h4-15,23-25H,3H2,1-2H3InChIKey
WYPPWWCARBUYMT-UHFFFAOYSA-NSynonyms
1acetyl17(2ethylphenyl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CCC1=CC=CC=C1N2C(=O)C3C4C5=CC=CC=C5C(C3C2=O)(C6=CC=CC=C46)C(=O)C
InChI=1SC28H23NO3c131710491522(17)2926(31)24231811571320(18)28(16(2)3025(24)27(29)32)2114861219(21)23h4152325H3H212H3
MFCD01070536
ZINC000004832667
ZINC000004832670
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