Vitas-M small molecule compound
2-methylpropyl 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
STK369013
SMILES CC(COC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)cccc3)C
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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 C29H25NO4 MW 451.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25NO4/c1-16(2)15-34-29(33)17-11-13-18(14-12-17)30-27(31)25-23-19-7-3-4-8-20(19)24(26(25)28(30)32)22-10-6-5-9-21(22)23/h3-14,16,23-26H,15H2,1-2H3InChIKey
ZTVKTPBVUOBSPG-UHFFFAOYSA-NSynonyms
2methylpropyl4(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)benzoate(nonpreferredname)
CC(C)COC(=O)C1=CC=C(C=C1)N2C(=O)C3C(C2=O)C4C5=CC=CC=C5C3C6=CC=CC=C46
InChI=1SC29H25NO4c116(2)153429(33)17111318(141217)3027(31)252319734820(19)24(26(25)28(30)32)221065921(22)23h314162326H15H212H3
MFCD00320926
ZINC000000704769
ZINC000013475768
Check stock
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Check stock on Vitas-MAvailable files
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