Vitas-M small molecule compound

4',4',6,6-tetramethyl-3-(naphthalen-1-yl)-3,5,6,7-tetrahydro-2'H,4H,6'H-spiro[1-benzofuran-2,1'-cyclohexane]-2',4,6'-trione

Catalog ID
STK833628
SMILES O=C1CC(C)(C)CC2=C1C(c1cccc3c1cccc3)C1(O2)C(=O)CC(CC1=O)(C)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 C27H28O4 MW 416.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28O4/c1-25(2)12-19(28)23-20(13-25)31-27(21(29)14-26(3,4)15-22(27)30)24(23)18-11-7-9-16-8-5-6-10-17(16)18/h5-11,24H,12-15H2,1-4H3
InChIKey
PRKGYLKHRIQVFN-UHFFFAOYSA-N
Synonyms
332025-62-4
332025624
4466tetramethyl3(naphthalen1yl)3567tetrahydro2H4H6Hspiro(1benzofuran21cyclohexane)246trione
4466tetramethyl3(naphthalen1yl)67dihydro3Hspiro(benzofuran21cyclohexane)246(5H)trione
5566tetramethyl3naphthalen1ylspiro(57dihydro3H1benzofuran22cyclohexane)134trione
CC1(CC2=C(C(C3(O2)C(=O)CC(CC3=O)(C)C)C4=CC=CC5=CC=CC=C54)C(=O)C1)C
InChI=1SC27H28O4c125(2)1219(28)2320(1325)3127(21(29)1426(34)1522(27)30)24(23)181179168561017(16)18h51124H1215H214H3
MFCD01176355
ZINC000000837279
ZINC000000837280

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Available files

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