Vitas-M small molecule compound
1-acetyl-17-(2-methylphenyl)-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
STK279654
SMILES Cc1ccccc1N1C(=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 C27H21NO3 MW 407.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21NO3/c1-15-9-3-8-14-21(15)28-25(30)23-22-17-10-4-6-12-19(17)27(16(2)29,24(23)26(28)31)20-13-7-5-11-18(20)22/h3-14,22-24H,1-2H3InChIKey
UCPSKNZORFDDFO-UHFFFAOYSA-NSynonyms
1acetyl17(2methylphenyl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CC1=CC=CC=C1N2C(=O)C3C4C5=CC=CC=C5C(C3C2=O)(C6=CC=CC=C46)C(=O)C
InChI=1SC27H21NO3c1159381421(15)2825(30)23221710461219(17)27(16(2)2924(23)26(28)31)2013751118(20)22h3142224H12H3
MFCD00545210
ZINC000000714822
ZINC000000714825
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