Vitas-M small molecule compound
3-[9-(2-ethoxyphenyl)-3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydroacridin-10(1H)-yl]propanoic acid
Catalog ID
STK074872
SMILES CCOc1ccccc1C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)CCC(=O)O
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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 C28H35NO5 MW 465.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35NO5/c1-6-34-22-10-8-7-9-17(22)24-25-18(13-27(2,3)15-20(25)30)29(12-11-23(32)33)19-14-28(4,5)16-21(31)26(19)24/h7-10,24H,6,11-16H2,1-5H3,(H,32,33)InChIKey
IJYOGIAEVJKWFF-UHFFFAOYSA-NSynonyms
3(9(2ethoxyphenyl)3366tetramethyl18dioxo23456789octahydroacridin10(1H)yl)propanoicacid
3(9(2ethoxyphenyl)3366tetramethyl18dioxo4579tetrahydro2Hacridin10yl)propanoicacid
CCOC1=CC=CC=C1C2C3=C(CC(CC3=O)(C)C)N(C4=C2C(=O)CC(C4)(C)C)CCC(=O)O
CCOc1ccccc1C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)CCC(=O)O
InChI=1SC28H35NO5c1634221087917(22)242518(1327(23)1520(25)30)29(121123(32)33)191428(45)1621(31)26(19)24h71024H61116H215H3(H3233)
MFCD03725749
STK074872
ZINC000000663724
ZINC663724
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