Vitas-M small molecule compound
1-acetyl-17-(3-acetylphenyl)-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
STK280982
SMILES CC(=O)c1cccc(c1)N1C(=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 C28H21NO4 MW 435.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21NO4/c1-15(30)17-8-7-9-18(14-17)29-26(32)24-23-19-10-3-5-12-21(19)28(16(2)31,25(24)27(29)33)22-13-6-4-11-20(22)23/h3-14,23-25H,1-2H3InChIKey
NLIPJTYNAKUCKG-UHFFFAOYSA-NSynonyms
1acetyl17(3acetylphenyl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CC(=O)C1=CC(=CC=C1)N2C(=O)C3C4C5=CC=CC=C5C(C3C2=O)(C6=CC=CC=C46)C(=O)C
InChI=1SC28H21NO4c115(30)1787918(1417)2926(32)24231910351221(19)28(16(2)3125(24)27(29)33)2213641120(22)23h3142325H12H3
MFCD01802306
ZINC000000708083
ZINC000000708086
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