Vitas-M small molecule compound

4-acetyl-1-(2-ethylhexyl)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one

Catalog ID
STK687845
SMILES CCCCC(CN1C(c2ccc(c(c2)OC)O)C(=C(C1=O)O)C(=O)C)CC

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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 C21H29NO5 MW 375.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29NO5/c1-5-7-8-14(6-2)12-22-19(18(13(3)23)20(25)21(22)26)15-9-10-16(24)17(11-15)27-4/h9-11,14,19,24-25H,5-8,12H2,1-4H3
InChIKey
VSSAUAPBRXWTHR-UHFFFAOYSA-N
Synonyms
3ACETYL1(2ETHYLHEXYL)4HYDROXY2(4HYDROXY3METHOXYPHENYL)2HPYRROL5ONE
4ACETYL1(2ETHYLHEXYL)3HYDROXY5(4HYDROXY3METHOXYPHENYL)15DIHYDRO2HPYRROL2ONE
CCCCC(CC)CN1C(C(=C(C1=O)O)C(=O)C)C2=CC(=C(C=C2)O)OC
Registry IDs
MFCD07022145
ZINC000004626430
ZINC000004626434

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.