Vitas-M small molecule compound
2-oxo-2-phenylethyl 2-(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)-3-methylbutanoate (non-preferred name)
Catalog ID
STK268480
SMILES CC(C(N1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)cccc3)C(=O)OCC(=O)c1ccccc1)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 C31H27NO5 MW 493.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27NO5/c1-17(2)28(31(36)37-16-23(33)18-10-4-3-5-11-18)32-29(34)26-24-19-12-6-7-13-20(19)25(27(26)30(32)35)22-15-9-8-14-21(22)24/h3-15,17,24-28H,16H2,1-2H3InChIKey
KEFMKFLPGWKQFL-UHFFFAOYSA-NSynonyms
2oxo2phenylethyl2(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)3methylbutanoate(nonpreferredname)
CC(C)C(C(=O)OCC(=O)C1=CC=CC=C1)N2C(=O)C3C(C2=O)C4C5=CC=CC=C5C3C6=CC=CC=C46
InChI=1SC31H27NO5c117(2)28(31(36)371623(33)18104351118)3229(34)26241912671320(19)25(27(26)30(32)35)2215981421(22)24h315172428H16H212H3
MFCD01210233
ZINC000004173896
ZINC000018156675
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