Vitas-M small molecule compound
9-(1,3-benzodioxol-5-yl)-10-(4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Catalog ID
STK996933
SMILES COc1ccc(cc1)N1C2=C(C(=O)CC(C2)(C)C)C(C2=C1CC(C)(C)CC2=O)c1ccc2c(c1)OCO2
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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 C31H33NO5 MW 499.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33NO5/c1-30(2)13-21-28(23(33)15-30)27(18-6-11-25-26(12-18)37-17-36-25)29-22(14-31(3,4)16-24(29)34)32(21)19-7-9-20(35-5)10-8-19/h6-12,27H,13-17H2,1-5H3InChIKey
FGQPHLLMLBCMCK-UHFFFAOYSA-NSynonyms
404921-24-0404921240
9(13benzodioxol5yl)10(4methoxyphenyl)3366tetramethyl3467910hexahydroacridine18(2H5H)dione
9(13benzodioxol5yl)10(4methoxyphenyl)3366tetramethyl4579tetrahydro2Hacridine18dione
9(benzo(d)(13)dioxol5yl)10(4methoxyphenyl)3366tetramethyl3467910hexahydroacridine18(2H5H)dione
CC1(CC2=C(C(C3=C(N2C4=CC=C(C=C4)OC)CC(CC3=O)(C)C)C5=CC6=C(C=C5)OCO6)C(=O)C1)C
InChI=1SC31H33NO5c130(2)132128(23(33)1530)27(186112526(1218)37173625)2922(1431(34)1624(29)34)32(21)197920(355)10819h61227H1317H215H3
MFCD03232487
ZINC000000985518
ZINC00985518
ZINC985518
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