Vitas-M small molecule compound
3-(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)phenyl 4-methylbenzoate (non-preferred name)
Catalog ID
STK275052
SMILES Cc1ccc(cc1)C(=O)Oc1cccc(c1)N1C(=O)C2C(C1=O)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 C32H23NO4 MW 485.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H23NO4/c1-18-13-15-19(16-14-18)32(36)37-21-8-6-7-20(17-21)33-30(34)28-26-22-9-2-3-10-23(22)27(29(28)31(33)35)25-12-5-4-11-24(25)26/h2-17,26-29H,1H3InChIKey
PJVOBEPZNSXQCE-UHFFFAOYSA-NSynonyms
3(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)phenyl4methylbenzoate(nonpreferredname)
CC1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)N3C(=O)C4C(C3=O)C5C6=CC=CC=C6C4C7=CC=CC=C57
InChI=1SC32H23NO4c118131519(161418)32(36)372186720(1721)3330(34)2826229231023(22)27(29(28)31(33)35)2512541124(25)26h2172629H1H3
MFCD03186842
ZINC000001161629
ZINC000017987623
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