Vitas-M small molecule compound
2-acetylphenyl 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)propanoate (non-preferred name)
Catalog ID
STK286485
SMILES O=C(Oc1ccccc1C(=O)C)CCN1C(=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 C29H23NO5 MW 465.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23NO5/c1-16(31)17-8-6-7-13-22(17)35-23(32)14-15-30-28(33)26-24-18-9-2-3-10-19(18)25(27(26)29(30)34)21-12-5-4-11-20(21)24/h2-13,24-27H,14-15H2,1H3InChIKey
YGCOJPINOCDFMD-UHFFFAOYSA-NSynonyms
2acetylphenyl3(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)propanoate(nonpreferredname)
CC(=O)C1=CC=CC=C1OC(=O)CCN2C(=O)C3C(C2=O)C4C5=CC=CC=C5C3C6=CC=CC=C46
InChI=1SC29H23NO5c116(31)178671322(17)3523(32)14153028(33)2624189231019(18)25(27(26)29(30)34)2112541120(21)24h2132427H1415H21H3
MFCD03577008
ZINC000001142206
ZINC000017917986
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