Vitas-M small molecule compound
benzyl 4-(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)benzoate (non-preferred name)
Catalog ID
STK268568
SMILES O=C(c1ccc(cc1)N1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)cccc3)OCc1ccccc1
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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/c34-30-28-26-22-10-4-5-11-23(22)27(25-13-7-6-12-24(25)26)29(28)31(35)33(30)21-16-14-20(15-17-21)32(36)37-18-19-8-2-1-3-9-19/h1-17,26-29H,18H2InChIKey
AVKNGGQVEJDOCE-UHFFFAOYSA-NSynonyms
benzyl4(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)benzoate(nonpreferredname)
C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)N3C(=O)C4C(C3=O)C5C6=CC=CC=C6C4C7=CC=CC=C57
InChI=1SC32H23NO4c343028262210451123(22)27(2513761224(25)26)29(28)31(35)33(30)21161420(151721)32(36)3718198213919h1172629H18H2
MFCD01174522
ZINC000000707244
ZINC000018246991
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