Vitas-M small molecule compound
[9-(2-methoxyphenyl)-3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydroacridin-10(1H)-yl]acetic acid
Catalog ID
STK075275
SMILES COc1ccccc1C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)CC(=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 C26H31NO5 MW 437.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31NO5/c1-25(2)10-16-23(18(28)12-25)22(15-8-6-7-9-20(15)32-5)24-17(27(16)14-21(30)31)11-26(3,4)13-19(24)29/h6-9,22H,10-14H2,1-5H3,(H,30,31)InChIKey
DMFWGTFCYCQVNI-UHFFFAOYSA-NSynonyms
(9(2methoxyphenyl)3366tetramethyl18dioxo23456789octahydroacridin10(1H)yl)aceticacid
2(9(2methoxyphenyl)3366tetramethyl18dioxo4579tetrahydro2Hacridin10yl)aceticacid
CC1(CC2=C(C(C3=C(N2CC(=O)O)CC(CC3=O)(C)C)C4=CC=CC=C4OC)C(=O)C1)C
COc1ccccc1C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)CC(=O)O
InChI=1SC26H31NO5c125(2)101623(18(28)1225)22(15867920(15)325)2417(27(16)1421(30)31)1126(34)1319(24)29h6922H1014H215H3(H3031)
MFCD02736495
STK075275
ZINC000019913883
ZINC19913883
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