Vitas-M small molecule compound
17-[4-(benzyloxy)phenyl]-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
STK553088
SMILES O=C1N(c2ccc(cc2)OCc2ccccc2)C(=O)C2C1C1c3ccccc3C2c2c1cccc2
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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 C31H23NO3 MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H23NO3/c33-30-28-26-22-10-4-5-11-23(22)27(25-13-7-6-12-24(25)26)29(28)31(34)32(30)20-14-16-21(17-15-20)35-18-19-8-2-1-3-9-19/h1-17,26-29H,18H2InChIKey
CZHBTJAWEIIZPY-UHFFFAOYSA-NSynonyms
1022308-69-5(9R10S11S15R)13(4(benzyloxy)phenyl)1011dihydro9H910(34)epipyrroloanthracene1214(13H15H)dione
1022308695
17(4(benzyloxy)phenyl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
C1=CC=C(C=C1)COC2=CC=C(C=C2)N3C(=O)C4C(C3=O)C5C6=CC=CC=C6C4C7=CC=CC=C57
InChI=1SC31H23NO3c333028262210451123(22)27(2513761224(25)26)29(28)31(34)32(30)20141621(171520)3518198213919h1172629H18H2
MFCD03349580
ZINC000002221617
ZINC000017823643
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